U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C9H10N2O5S
Molecular Weight 258.251
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 2-(((AMINOCARBONYL)AMINO)SULFONYL)BENZOATE

SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)NC(N)=O

InChI

InChIKey=SRCPGSKDFKGYHP-UHFFFAOYSA-N
InChI=1S/C9H10N2O5S/c1-16-8(12)6-4-2-3-5-7(6)17(14,15)11-9(10)13/h2-5H,1H3,(H3,10,11,13)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
METHYL 2-(((AMINOCARBONYL)AMINO)SULFONYL)BENZOATE
Systematic Name English
BENZOIC ACID, 2-(((AMINOCARBONYL)AMINO)SULFONYL)-, METHYL ESTER
Preferred Name English
Code System Code Type Description
FDA UNII
1242J3DQQO
Created by admin on Mon Mar 31 22:48:14 GMT 2025 , Edited by admin on Mon Mar 31 22:48:14 GMT 2025
PRIMARY
CAS
95473-30-6
Created by admin on Mon Mar 31 22:48:14 GMT 2025 , Edited by admin on Mon Mar 31 22:48:14 GMT 2025
PRIMARY
EPA CompTox
DTXSID80241853
Created by admin on Mon Mar 31 22:48:14 GMT 2025 , Edited by admin on Mon Mar 31 22:48:14 GMT 2025
PRIMARY
PUBCHEM
185403
Created by admin on Mon Mar 31 22:48:14 GMT 2025 , Edited by admin on Mon Mar 31 22:48:14 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966