methyl 2-(3-benzamido-2-oxidanylidene-4-phenyl-butyl)sulfanylethanoate

Systemtic Name: methyl 2-(3-benzamido-2-oxidanylidene-4-phenyl-butyl)sulfanylethanoate Openeye Name: methyl 2-(3-benzamido-2-oxo-4-phenyl-butyl)sulfanylacetate CAS Name: 2-[(3-benzamido-2-oxo-4-phenylbutyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(3-benzamido-2-oxo-4-phenylbutyl)sulfanylacetate Traditional Name: 2-[(3-benzamido-2-keto-4-phenyl-butyl)thio]acetic acid methyl ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CSCC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC=CC=C2

InChI

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