5-[[4-(cyanomethyl)phenyl]sulfamoyl]thiophene-3-carboxylic acid

Systemtic Name: 5-[[4-(cyanomethyl)phenyl]sulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[[4-(cyanomethyl)phenyl]sulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[[4-(cyanomethyl)phenyl]sulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[[4-(cyanomethyl)phenyl]sulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[[4-(cyanomethyl)phenyl]sulfamoyl]-3-thenoic acid Formula: C13H10N2O4S2 MolecularWeight: 322.3595

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)NS(=O)(=O)C2=CC(=CS2)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CC#N)NS(=O)(=O)C2=CC(=CS2)C(=O)O

InChI

InChI=1S/C13H10N2O4S2/c14-6-5-9-1-3-11(4-2-9)15-21(18,19)12-7-10(8-20-12)13(16)17/h1-4,7-8,15H,5H2,(H,16,17)