Substances (GSRS)

4,4'-BIS(ISOPENTYLOXY)THIOCARBANILIDE

Also: DAT-C, DATC, ISOXYL +7

chemicalUNII 43M23X81Y2

Open FDA's page for this record

Substance class

chemical

Definition type

PRIMARY

Definition level

COMPLETE

Uuid

8f6908a2-861e-4a44-b551-f3d6f774315b

Version

UNII

43M23X81Y2

Codes

Uuid
03300449-3bb6-4e94-a079-86a403ce056e
Code
J04AD02
Comments
ATC|ANTIINFECTIVES FOR SYSTEMIC USE|ANTIMYCOBACTERIALS|DRUGS FOR TREATMENT OF TUBERCULOSIS|Thiocarbamide derivatives|tiocarlide
Type
PRIMARY
Url
http://www.whocc.no/atc_ddd_index/?code=J04AD02&showdescription=yes
Code system
WHO-ATC
References
477d2cfa-b8b2-4f9a-ba9a-eb15d68ae81e
Uuid
f0eae15b-78e1-4b28-a132-b158ea4f3794
Code
QJ04AD02
Comments
VATC|ANTIMYCOBACTERIALS|DRUGS FOR TREATMENT OF TUBERCULOSIS|Thiocarbamide derivatives|tiocarlide
Type
PRIMARY
Url
http://www.whocc.no/atcvet/atcvet_index/?code=QJ04AD02&showdescription=yes
Code system
WHO-VATC
References
477d2cfa-b8b2-4f9a-ba9a-eb15d68ae81e
Uuid
138f8179-5d08-41a1-97ea-7304483c04b5
Code
910-86-1
Type
PRIMARY
Url
https://commonchemistry.cas.org/detail?cas_rn=910-86-1
Code system
CAS
References
477d2cfa-b8b2-4f9a-ba9a-eb15d68ae81e, b38997ef-1171-4405-8589-4422dc0869fe
Uuid
e6cb6fc0-6e07-4a68-943b-831c88ac4c91
Code
C100189
Type
PRIMARY
Url
http://www.ncbi.nlm.nih.gov/mesh/67100189
Code system
MESH
References
477d2cfa-b8b2-4f9a-ba9a-eb15d68ae81e
Uuid
31181616-93cb-43d5-8438-fe75430bf867
Code
THIOCARLIDE
Type
PRIMARY
Url
https://en.wikipedia.org/wiki/Thiocarlide
Code system
WIKIPEDIA
References
477d2cfa-b8b2-4f9a-ba9a-eb15d68ae81e
Uuid
f3bddfd9-53b0-4315-be33-73e3c1cda097
Code
SUB11078MIG
Type
PRIMARY
Code system
EVMPD
References
477d2cfa-b8b2-4f9a-ba9a-eb15d68ae81e
Uuid
fdfa6529-2f59-488d-bea3-797d2680cce8
Code
1597
Type
PRIMARY
Url
https://extranet.who.int/soinn/mod/page/view.php?id=137&inn_n=1597
Code system
INN
References
477d2cfa-b8b2-4f9a-ba9a-eb15d68ae81e
Uuid
8ac5a696-ae6a-4150-969b-581991572b91
Code
213-006-5
Type
PRIMARY
Url
https://echa.europa.eu/substance-information/-/substanceinfo/100.011.824
Code system
ECHA (EC/EINECS)
References
477d2cfa-b8b2-4f9a-ba9a-eb15d68ae81e
Uuid
4a1e1aee-0af5-4ca0-8f02-875c1acc1d55
Code
m968
Comments
Merck Index
Type
PRIMARY
Url
https://merckindex.rsc.org/monographs/m968?q=authorize
Code system
MERCK INDEX
References
477d2cfa-b8b2-4f9a-ba9a-eb15d68ae81e
Uuid
7f07bd34-d4fa-46a6-b028-45af252cc039
Code
CHEMBL214920
Type
PRIMARY
Url
https://www.ebi.ac.uk/chembl/compound/inspect/CHEMBL214920
Code system
ChEMBL
References
477d2cfa-b8b2-4f9a-ba9a-eb15d68ae81e
Uuid
c5e35b97-1a4e-4d43-9bed-648e860294e6
Code
3001386
Type
PRIMARY
Url
https://pubchem.ncbi.nlm.nih.gov/compound/3001386
Code system
PUBCHEM
References
477d2cfa-b8b2-4f9a-ba9a-eb15d68ae81e
Uuid
3d6860b0-8def-fbef-8468-90e8aa00cb4b
Code
DTXSID70238358
Type
PRIMARY
Url
https://comptox.epa.gov/dashboard/chemical/details/DTXSID70238358
Code system
EPA CompTox
References
4a491947-1969-09fe-8702-ec3ef984450e
+7 more not shown

Relationships

Uuid
ec3ba796-b4e1-46b9-b98b-4d3e4b85e0c8
Type
ACTIVE MOIETY
Related substance
Uuid
369e0362-6272-4e00-85ef-06404d576696
Refuuid
8f6908a2-861e-4a44-b551-f3d6f774315b
Name
TIOCARLIDE
UNII
43M23X81Y2
Linking ID
43M23X81Y2
Ref pname
TIOCARLIDE
Substance class
reference

Names

Uuid
6d9e9fbb-372b-4e7d-ab5f-af9a13403903
Name
4,4'-BIS(ISOPENTYLOXY)THIOCARBANILIDE
StdName
4,4'-BIS(ISOPENTYLOXY)THIOCARBANILIDE
Type
cn
Preferred
false
Display name
false
Languages
en
References
b44f4726-26c4-4245-a3f4-29e4a4889c13
Uuid
d72a4a75-c3b4-4bd3-a1f5-8b5d20143949
Name
DAT-C
StdName
DAT-C
Type
cd
Preferred
false
Display name
false
Languages
en
References
a1a8cbe2-48da-4e85-94b8-87ad7300cfa7
Uuid
311353f4-f8f7-42a6-a27a-8ef6aa7fab4c
Name
DATC
StdName
DATC
Type
cd
Preferred
false
Display name
false
Languages
en
References
a1a8cbe2-48da-4e85-94b8-87ad7300cfa7
Uuid
75cbc5a9-f711-41f0-b0fc-0ff126f429e6
Name
ISOXYL
StdName
ISOXYL
Type
cn
Preferred
false
Display name
false
Languages
en
References
640002b7-6aab-4312-9d62-5bedbfe8b2ac
Uuid
3b689eb4-fdbd-54f5-2a9c-3ac643c3fea8
Name
NSC-742400
StdName
NSC-742400
Type
cd
Preferred
false
Display name
false
Languages
en
References
14a167fc-8483-1030-dcd5-4679c34c0131
Uuid
973b7fc7-afc2-43d1-8be3-f8ea21badd9e
Name
THIOCARLIDE
StdName
THIOCARLIDE
Type
cn
Preferred
false
Display name
false
Languages
en
References
b44f4726-26c4-4245-a3f4-29e4a4889c13
Uuid
90358c9d-479e-4405-ab8e-15cf2f672e4a
Name
TIOCARLIDE
StdName
TIOCARLIDE
Type
of
Preferred
false
Display name
true
Languages
en
References
b1cef930-bab3-4ed4-a28b-1ca4d2c55870, cee5d070-5fee-4289-ab23-1441c9db03ab, c9400e84-4bdc-4a0b-948e-d4bb309cfd4f, 7c4709c2-0ed6-487e-883b-17b397318118, b44f4726-26c4-4245-a3f4-29e4a4889c13, 9d792d88-fe77-4f0e-a36a-7c473622399d, 6b8a3204-fee6-4f2c-b2d4-822bf124d10e, 5a0e29b4-133e-497f-b061-22b2235e4b9d, b055ab69-4c44-412f-9919-e8a6d1941a54
Domains
drug
Name orgs
1. Uuid
  fb45b717-5ece-4ab9-97a4-0ccd5b0f7da3
  Name org
  INN
Uuid
1f33fcd7-2ed8-42dd-8e88-e7590a0ab72f
Name
TIOCARLIDE [MART.]
StdName
TIOCARLIDE [MART.]
Type
cn
Preferred
false
Display name
false
Languages
en
References
7c4709c2-0ed6-487e-883b-17b397318118
Uuid
6bd41e1d-5fd9-41c8-b58e-fb9459cf218f
Name
TIOCARLIDE [MI]
StdName
TIOCARLIDE [MI]
Type
cn
Preferred
false
Display name
false
Languages
en
References
6b8a3204-fee6-4f2c-b2d4-822bf124d10e
Uuid
c788a4aa-7824-2286-ab06-c63f256fb205
Name
Tiocarlide [WHO-DD]
StdName
TIOCARLIDE [WHO-DD]
Type
cn
Preferred
false
Display name
false
Languages
en
References
455c353f-7d5f-57c8-0d39-cf6411dd9bf4
Uuid
0687b44c-33e8-4ffd-97fb-ed5c37a025f5
Name
tiocarlide [INN]
StdName
TIOCARLIDE [INN]
Type
cn
Preferred
false
Display name
false
Languages
en
References
b1cef930-bab3-4ed4-a28b-1ca4d2c55870

References

Uuid
b44f4726-26c4-4245-a3f4-29e4a4889c13
Citation
USP DICTIONARY 2010
Doc type
SRS
Public domain
true
Tags
NOMEN, PUBLIC_DOMAIN_RELEASE, AUTO_SELECTED
Uuid
b1cef930-bab3-4ed4-a28b-1ca4d2c55870
Citation
INN Proposed List 14
Url
https://www.who.int/medicines/publications/druginformation/innlists/PL14.pdf
Doc type
INN_LIST
Public domain
true
Tags
PUBLIC_DOMAIN_RELEASE
Uuid
7c4709c2-0ed6-487e-883b-17b397318118
Citation
MARTINDALE 2011
Doc type
SRS
Public domain
true
Tags
NOMEN
Uuid
5a0e29b4-133e-497f-b061-22b2235e4b9d
Citation
WHO-DD
Doc type
SRS
Public domain
true
Tags
NOMEN
Uuid
640002b7-6aab-4312-9d62-5bedbfe8b2ac
Citation
https://www.caymanchem.com/app/template/Product.vm/catalog/10006976
Url
https://www.caymanchem.com/app/template/Product.vm/catalog/10006976
Doc type
SRS
Public domain
true
Tags
NOMEN
Uuid
6b8a3204-fee6-4f2c-b2d4-822bf124d10e
Citation
MERCK
Doc type
SRS
Public domain
true
Tags
NOMEN
Uuid
a1a8cbe2-48da-4e85-94b8-87ad7300cfa7
Citation
USP DICTIONARY
Doc type
SRS
Public domain
true
Tags
NOMEN
Uuid
477d2cfa-b8b2-4f9a-ba9a-eb15d68ae81e
Citation
SRS CODE IMPORT
Doc type
SRS
Public domain
true
Document date
1493389698000
Tags
NOMEN
Uuid
6b8fb896-33c3-4978-bd70-ed2038690100
Citation
SRS import [43M23X81Y2]
Url
http://fdasis.nlm.nih.gov/srs/srsdirect.jsp?regno=43M23X81Y2
Doc type
SRS
Public domain
true
Document date
1493389698000
Tags
NOMEN
Uuid
cee5d070-5fee-4289-ab23-1441c9db03ab
Citation
TIOCARLIDE [INN]
Doc type
SRS_LOCATOR
Public domain
true
Uuid
b055ab69-4c44-412f-9919-e8a6d1941a54
Citation
TIOCARLIDE [MART.]
Doc type
SRS_LOCATOR
Public domain
true
Uuid
c9400e84-4bdc-4a0b-948e-d4bb309cfd4f
Citation
TIOCARLIDE [WHO-DD]
Doc type
SRS_LOCATOR
Public domain
true
+8 more not shown

Moieties

Uuid
c6d53675-470e-47c4-bce1-117e42a7aa05
ID
c6d53675-470e-47c4-bce1-117e42a7aa05
Smiles
CC(C)CCOc1ccc(cc1)NC(=S)Nc2ccc(cc2)OCCC(C)C
Formula
C23H32N2O2S
Atropisomerism
No
Charge
0
Count
1
Stereochemistry
ACHIRAL
Defined stereo
0
Ez centers
0
Molecular weight
400.5793
Optical activity
NONE
Stereo centers
0
Molfile
Marvin 01132110172D 28 29 0 0 0 0 999 V2000 1.2440 -0.1267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5767 -0.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5767 -1.3836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2983 -1.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2983 -2.6250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9965 -3.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9965 -3.8663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7258 -4.2827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4447 -3.8663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1534 -4.2827 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8723 -3.8663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8723 -3.0413 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5887 -4.2827 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2947 -3.8663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0291 -4.2827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7378 -3.8663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7378 -3.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4489 -2.6250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4489 -1.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1653 -1.3836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1653 -0.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8454 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5524 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0291 -2.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2947 -3.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4447 -3.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7258 -2.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 3 2 1 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 8 7 1 0 0 0 0 7 28 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 27 10 2 0 0 0 0 11 12 1 0 0 0 0 13 12 2 0 0 0 0 14 12 1 0 0 0 0 15 14 1 0 0 0 0 16 15 1 0 0 0 0 26 15 2 0 0 0 0 17 16 2 0 0 0 0 17 18 1 0 0 0 0 19 18 1 0 0 0 0 18 25 2 0 0 0 0 20 19 1 0 0 0 0 21 20 1 0 0 0 0 22 21 1 0 0 0 0 23 22 1 0 0 0 0 24 22 1 0 0 0 0 25 26 1 0 0 0 0 28 27 1 0 0 0 0 M END
Count amount
Type
MOL RATIO
Average
1
Units
MOL RATIO
Uuid
d98d2c9b-e8f6-48c7-a6a5-8b7ba02859c1

Structure

ID: 120c7933-708e-4b8d-a1c3-e69040d91af6
Smiles: CC(C)CCOc1ccc(cc1)NC(=S)Nc2ccc(cc2)OCCC(C)C
Formula: C23H32N2O2S
Atropisomerism: No
Charge: 0
Count: 1
Stereochemistry: ACHIRAL
Defined stereo: 0
Ez centers: 0
Molecular weight: 400.5793
Optical activity: NONE
Stereo centers: 0
Molfile: Marvin 01132101092D 28 29 0 0 0 0 999 V2000 4.8723 -3.8663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1534 -4.2827 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5887 -4.2827 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8723 -3.0413 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4447 -3.8663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2947 -3.8663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9965 -3.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7378 -3.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7258 -4.2827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0291 -4.2827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4447 -3.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2947 -3.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7378 -3.8663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9965 -3.8663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0291 -2.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7258 -2.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4489 -2.6250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2983 -2.6250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4489 -1.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2983 -1.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1653 -1.3836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5767 -1.3836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5767 -0.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1653 -0.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -0.1267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8454 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5524 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 1 1 0 0 0 0 4 1 2 0 0 0 0 5 2 1 0 0 0 0 6 3 1 0 0 0 0 7 16 1 0 0 0 0 8 15 1 0 0 0 0 9 5 2 0 0 0 0 10 6 2 0 0 0 0 11 5 1 0 0 0 0 12 6 1 0 0 0 0 13 10 1 0 0 0 0 14 9 1 0 0 0 0 15 12 2 0 0 0 0 16 11 2 0 0 0 0 17 8 1 0 0 0 0 18 7 1 0 0 0 0 19 17 1 0 0 0 0 20 18 1 0 0 0 0 21 19 1 0 0 0 0 22 20 1 0 0 0 0 23 22 1 0 0 0 0 24 21 1 0 0 0 0 25 23 1 0 0 0 0 26 23 1 0 0 0 0 27 24 1 0 0 0 0 28 24 1 0 0 0 0 13 8 2 0 0 0 0 14 7 2 0 0 0 0 M END
References: b44f4726-26c4-4245-a3f4-29e4a4889c13, 6b8fb896-33c3-4978-bd70-ed2038690100, b1cef930-bab3-4ed4-a28b-1ca4d2c55870

Data from openFDA, FDA's public API. FDA says not to rely on it to make decisions about medical care and to treat every result as unvalidated; confirm against FDA's own record and the product labeling. Not medical or legal advice.