3-[(2-methyl-3-oxidanylidene-3-phenyl-propanethioyl)amino]-2-oxidanyl-4-phenyl-butanoic acid

Systemtic Name: 3-[(2-methyl-3-oxidanylidene-3-phenyl-propanethioyl)amino]-2-oxidanyl-4-phenyl-butanoic acid Openeye Name: 2-hydroxy-3-[(2-methyl-3-oxo-3-phenyl-propanethioyl)amino]-4-phenyl-butanoic acid CAS Name: 2-hydroxy-3-[(2-methyl-3-oxo-3-phenyl-1-sulfanylidenepropyl)amino]-4-phenylbutanoic acid IUPAC Name: 2-hydroxy-3-[(2-methyl-3-oxo-3-phenylpropanethioyl)amino]-4-phenylbutanoic acid Traditional Name: 2-hydroxy-3-[(3-keto-2-methyl-3-phenyl-propanethioyl)amino]-4-phenyl-butyric acid Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)C(=S)NC(CC2=CC=CC=C2)C(C(=O)O)O

Isomeric SMILES

CC(C(=O)C1=CC=CC=C1)C(=S)NC(CC2=CC=CC=C2)C(C(=O)O)O

InChI

InChI=1S/C20H21NO4S/c1-13(17(22)15-10-6-3-7-11-15)19(26)21-16(18(23)20(24)25)12-14-8-4-2-5-9-14/h2-11,13,16,18,23H,12H2,1H3,(H,21,26)(H,24,25)