3-[(2-methoxy-4-methyl-phenyl)carbonyl-methyl-amino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[(2-methoxy-4-methyl-phenyl)carbonyl-methyl-amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[(2-methoxy-4-methyl-benzoyl)-methyl-amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[[(2-methoxy-4-methylphenyl)-oxomethyl]-methylamino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[(2-methoxy-4-methylbenzoyl)-methylamino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[(2-methoxy-4-methyl-benzoyl)-methyl-amino]-5-phenyl-2-thenoic acid Formula: C21H19NO4S MolecularWeight: 381.44486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)N(C)C2=C(SC(=C2)C3=CC=CC=C3)C(=O)O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)N(C)C2=C(SC(=C2)C3=CC=CC=C3)C(=O)O)OC

InChI

InChI=1S/C21H19NO4S/c1-13-9-10-15(17(11-13)26-3)20(23)22(2)16-12-18(27-19(16)21(24)25)14-7-5-4-6-8-14/h4-12H,1-3H3,(H,24,25)