propan-2-yl 3-[(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanylmethyl]benzoate

Systemtic Name: propan-2-yl 3-[(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanylmethyl]benzoate Openeye Name: isopropyl 3-[(2-anilino-2-oxo-ethyl)sulfanylmethyl]benzoate CAS Name: 3-[[(2-anilino-2-oxoethyl)thio]methyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[(2-anilino-2-oxoethyl)sulfanylmethyl]benzoate Traditional Name: 3-[[(2-anilino-2-keto-ethyl)thio]methyl]benzoic acid isopropyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC(=CC=C1)CSCC(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)OC(=O)C1=CC(=CC=C1)CSCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C19H21NO3S/c1-14(2)23-19(22)16-8-6-7-15(11-16)12-24-13-18(21)20-17-9-4-3-5-10-17/h3-11,14H,12-13H2,1-2H3,(H,20,21)