2-[[2-(2-methyl-3-oxidanylidene-3-phenyl-2-sulfanyl-propanoyl)phenyl]amino]ethanoic acid

Systemtic Name: 2-[[2-(2-methyl-3-oxidanylidene-3-phenyl-2-sulfanyl-propanoyl)phenyl]amino]ethanoic acid Openeye Name: 2-[2-(2-methyl-3-oxo-3-phenyl-2-sulfanyl-propanoyl)anilino]acetic acid CAS Name: 2-[2-(2-mercapto-2-methyl-1,3-dioxo-3-phenylpropyl)anilino]acetic acid IUPAC Name: 2-[2-(2-methyl-3-oxo-3-phenyl-2-sulfanylpropanoyl)anilino]acetic acid Traditional Name: 2-[2-(3-keto-2-mercapto-2-methyl-3-phenyl-propanoyl)anilino]acetic acid Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)(C(=O)C2=CC=CC=C2NCC(=O)O)S

Isomeric SMILES

CC(C(=O)C1=CC=CC=C1)(C(=O)C2=CC=CC=C2NCC(=O)O)S

InChI

InChI=1S/C18H17NO4S/c1-18(24,16(22)12-7-3-2-4-8-12)17(23)13-9-5-6-10-14(13)19-11-15(20)21/h2-10,19,24H,11H2,1H3,(H,20,21)