3-[(3-cyanothiophen-2-yl)sulfamoyl]-4-methyl-benzoic acid

Systemtic Name: 3-[(3-cyanothiophen-2-yl)sulfamoyl]-4-methyl-benzoic acid Openeye Name: 3-[(3-cyano-2-thienyl)sulfamoyl]-4-methyl-benzoic acid CAS Name: 3-[(3-cyano-2-thiophenyl)sulfamoyl]-4-methylbenzoic acid IUPAC Name: 3-[(3-cyanothiophen-2-yl)sulfamoyl]-4-methylbenzoic acid Traditional Name: 3-[(3-cyano-2-thienyl)sulfamoyl]-4-methyl-benzoic acid Formula: C13H10N2O4S2 MolecularWeight: 322.3595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=C(C=CS2)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=C(C=CS2)C#N

InChI

InChI=1S/C13H10N2O4S2/c1-8-2-3-9(13(16)17)6-11(8)21(18,19)15-12-10(7-14)4-5-20-12/h2-6,15H,1H3,(H,16,17)