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

Details

Stereochemistry ACHIRAL
Molecular Formula C11H10N2O2S
Molecular Weight 234.274
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 2,3-dihydro-3-phenyl-2-thioxo-1H-imidazole-4-carboxylate

SMILES

COC(=O)C1=CNC(=S)N1C2=CC=CC=C2

InChI

InChIKey=LBAHSLRQMFWHLF-UHFFFAOYSA-N
InChI=1S/C11H10N2O2S/c1-15-10(14)9-7-12-11(16)13(9)8-5-3-2-4-6-8/h2-7H,1H3,(H,12,16)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
NSC-97021
Preferred Name English
Methyl 2,3-dihydro-3-phenyl-2-thioxo-1H-imidazole-4-carboxylate
Systematic Name English
Methyl 3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxylate
Systematic Name English
1H-Imidazole-4-carboxylic acid, 2,3-dihydro-3-phenyl-2-thioxo-, methyl ester
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID20232604
Created by admin on Tue Apr 01 20:24:19 GMT 2025 , Edited by admin on Tue Apr 01 20:24:19 GMT 2025
PRIMARY
FDA UNII
45Z7GJQ7T4
Created by admin on Tue Apr 01 20:24:19 GMT 2025 , Edited by admin on Tue Apr 01 20:24:19 GMT 2025
PRIMARY
ECHA (EC/EINECS)
280-693-6
Created by admin on Tue Apr 01 20:24:19 GMT 2025 , Edited by admin on Tue Apr 01 20:24:19 GMT 2025
PRIMARY
NSC
97021
Created by admin on Tue Apr 01 20:24:19 GMT 2025 , Edited by admin on Tue Apr 01 20:24:19 GMT 2025
PRIMARY
CAS
83763-09-1
Created by admin on Tue Apr 01 20:24:19 GMT 2025 , Edited by admin on Tue Apr 01 20:24:19 GMT 2025
PRIMARY
PUBCHEM
3034542
Created by admin on Tue Apr 01 20:24:19 GMT 2025 , Edited by admin on Tue Apr 01 20:24:19 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