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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H9N3O2S
Molecular Weight 259.284
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Methyl-2-((4-nitrophenyl)amino)thiophene-3-carbonitrile

SMILES

CC1=CC(C#N)=C(NC2=CC=C(C=C2)[N+]([O-])=O)S1

InChI

InChIKey=ZNIPHXMTWOFLRA-UHFFFAOYSA-N
InChI=1S/C12H9N3O2S/c1-8-6-9(7-13)12(18-8)14-10-2-4-11(5-3-10)15(16)17/h2-6,14H,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
5-Methyl-2-((4-nitrophenyl)amino)thiophene-3-carbonitrile
Preferred Name English
Code System Code Type Description
PUBCHEM
168445526
Created by admin on Wed Apr 02 21:25:20 GMT 2025 , Edited by admin on Wed Apr 02 21:25:20 GMT 2025
PRIMARY
FDA UNII
5T9GZ3NC6U
Created by admin on Wed Apr 02 21:25:20 GMT 2025 , Edited by admin on Wed Apr 02 21:25:20 GMT 2025
PRIMARY