CP-100829

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H7Cl2FN2O3S
Molecular Weight	373.186
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of CP-100829

Structure Search

SMILES

NC(=O)N1C(=O)\C(=C(/O)C2=CC(Cl)=CS2)C3=CC(F)=C(Cl)C=C13

InChI

InChIKey=RQPSIRZEVZUYOF-QXMHVHEDSA-N

InChI=1S/C14H7Cl2FN2O3S/c15-5-1-10(23-4-5)12(20)11-6-2-8(17)7(16)3-9(6)19(13(11)21)14(18)22/h1-4,20H,(H2,18,22)/b12-11-

HIDE SMILES / InChI

Molecular Formula	C14H7Cl2FN2O3S
Molecular Weight	373.186
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:04:58 GMT 2025` Edited by `admin` on `Mon Mar 31 18:04:58 GMT 2025`
Record UNII	X7Y3B8B649
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

1H-INDOLE-1-CARBOXAMIDE, 6-CHLORO-3-((4-CHLORO-2-THIENYL)CARBONYL)-5-FLUORO-2,3-DIHYDRO-2-OXO-

Preferred Name

English

CP-100829

Code

English

1H-INDOLE-1-CARBOXAMIDE, 6-CHLORO-3-((4-CHLORO-2-THIENYL)HYDROXYMETHYLENE)-5-FLUORO-2,3-DIHYDRO-2-OXO-, (Z)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

54717248

Created by admin on Mon Mar 31 18:04:58 GMT 2025 , Edited by admin on Mon Mar 31 18:04:58 GMT 2025

PRIMARY

FDA UNII

X7Y3B8B649

Created by admin on Mon Mar 31 18:04:58 GMT 2025 , Edited by admin on Mon Mar 31 18:04:58 GMT 2025

PRIMARY

CAS

135080-03-4

Created by admin on Mon Mar 31 18:04:58 GMT 2025 , Edited by admin on Mon Mar 31 18:04:58 GMT 2025

ALTERNATIVE

EPA CompTox

DTXSID401109093

Created by admin on Mon Mar 31 18:04:58 GMT 2025 , Edited by admin on Mon Mar 31 18:04:58 GMT 2025

PRIMARY

CAS

172618-05-2

Created by admin on Mon Mar 31 18:04:58 GMT 2025 , Edited by admin on Mon Mar 31 18:04:58 GMT 2025

PRIMARY