[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 2-(2-oxidanylidenepropylsulfanyl)benzoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 2-(2-oxidanylidenepropylsulfanyl)benzoate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 2-acetonylsulfanylbenzoate CAS Name: 2-(2-oxopropylthio)benzoic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 2-(2-oxopropylsulfanyl)benzoate Traditional Name: 2-(acetonylthio)benzoic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C19H19NO4S MolecularWeight: 357.42346

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=CC=CC=C1C(=O)OCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC(=O)CSC1=CC=CC=C1C(=O)OCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C19H19NO4S/c1-14(21)13-25-17-10-6-5-9-16(17)19(23)24-12-18(22)20-11-15-7-3-2-4-8-15/h2-10H,11-13H2,1H3,(H,20,22)