3-[(4-methylphenyl)carbonylamino]-4-oxidanylidene-4-thiophen-2-yl-butanoic acid

Systemtic Name: 3-[(4-methylphenyl)carbonylamino]-4-oxidanylidene-4-thiophen-2-yl-butanoic acid Openeye Name: 3-[(4-methylbenzoyl)amino]-4-oxo-4-(2-thienyl)butanoic acid CAS Name: 3-[[(4-methylphenyl)-oxomethyl]amino]-4-oxo-4-thiophen-2-ylbutanoic acid IUPAC Name: 3-[(4-methylbenzoyl)amino]-4-oxo-4-thiophen-2-ylbutanoic acid Traditional Name: 4-keto-3-(p-toluoylamino)-4-(2-thienyl)butyric acid Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(CC(=O)O)C(=O)C2=CC=CS2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(CC(=O)O)C(=O)C2=CC=CS2

InChI

InChI=1S/C16H15NO4S/c1-10-4-6-11(7-5-10)16(21)17-12(9-14(18)19)15(20)13-3-2-8-22-13/h2-8,12H,9H2,1H3,(H,17,21)(H,18,19)