4-[(3-cyano-4,5-dimethyl-thiophen-2-yl)amino]-4-oxidanylidene-2-phenyl-butanoic acid

Systemtic Name: 4-[(3-cyano-4,5-dimethyl-thiophen-2-yl)amino]-4-oxidanylidene-2-phenyl-butanoic acid Openeye Name: 4-[(3-cyano-4,5-dimethyl-2-thienyl)amino]-4-oxo-2-phenyl-butanoic acid CAS Name: 4-[(3-cyano-4,5-dimethyl-2-thiophenyl)amino]-4-oxo-2-phenylbutanoic acid IUPAC Name: 4-[(3-cyano-4,5-dimethylthiophen-2-yl)amino]-4-oxo-2-phenylbutanoic acid Traditional Name: 4-[(3-cyano-4,5-dimethyl-2-thienyl)amino]-4-keto-2-phenyl-butyric acid Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)CC(C2=CC=CC=C2)C(=O)O)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)CC(C2=CC=CC=C2)C(=O)O)C

InChI

InChI=1S/C17H16N2O3S/c1-10-11(2)23-16(14(10)9-18)19-15(20)8-13(17(21)22)12-6-4-3-5-7-12/h3-7,13H,8H2,1-2H3,(H,19,20)(H,21,22)