2-ACETAMIDO-6-(PHENYLTHIO)BENZOIC ACID

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H13NO3S
Molecular Weight	287.334
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-ACETAMIDO-6-(PHENYLTHIO)BENZOIC ACID

Structure Search

SMILES

CC(=O)NC1=CC=CC(SC2=CC=CC=C2)=C1C(O)=O

InChI

InChIKey=VOKXGVHRVUGNCQ-UHFFFAOYSA-N

InChI=1S/C15H13NO3S/c1-10(17)16-12-8-5-9-13(14(12)15(18)19)20-11-6-3-2-4-7-11/h2-9H,1H3,(H,16,17)(H,18,19)

HIDE SMILES / InChI

Molecular Formula	C15H13NO3S
Molecular Weight	287.334
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 `Tue Apr 01 17:36:32 GMT 2025` Edited by `admin` on `Tue Apr 01 17:36:32 GMT 2025`
Record UNII	VZ2CB55VQE
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

2-ACETAMIDO-6-(PHENYLTHIO)BENZOIC ACID

Systematic Name

English

BENZOIC ACID, 2-(ACETYLAMINO)-6-(PHENYLTHIO)-

Preferred Name

English

Code System Code Type Description

FDA UNII

VZ2CB55VQE

Created by admin on Tue Apr 01 17:36:32 GMT 2025 , Edited by admin on Tue Apr 01 17:36:32 GMT 2025

PRIMARY

EPA CompTox

DTXSID00233432

Created by admin on Tue Apr 01 17:36:32 GMT 2025 , Edited by admin on Tue Apr 01 17:36:32 GMT 2025

PRIMARY

CAS

84455-38-9

Created by admin on Tue Apr 01 17:36:32 GMT 2025 , Edited by admin on Tue Apr 01 17:36:32 GMT 2025

PRIMARY

ECHA (EC/EINECS)

282-900-5

Created by admin on Tue Apr 01 17:36:32 GMT 2025 , Edited by admin on Tue Apr 01 17:36:32 GMT 2025

PRIMARY

PUBCHEM

3019896

Created by admin on Tue Apr 01 17:36:32 GMT 2025 , Edited by admin on Tue Apr 01 17:36:32 GMT 2025

PRIMARY