[(2S)-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl] 2-(4-chlorophenyl)sulfanylethanoate

Systemtic Name: [(2S)-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl] 2-(4-chlorophenyl)sulfanylethanoate Openeye Name: [(1S)-1-(benzylcarbamoyl)propyl] 2-(4-chlorophenyl)sulfanylacetate CAS Name: 2-[(4-chlorophenyl)thio]acetic acid [(2S)-1-oxo-1-[(phenylmethyl)amino]butan-2-yl] ester IUPAC Name: [(2S)-1-(benzylamino)-1-oxobutan-2-yl] 2-(4-chlorophenyl)sulfanylacetate Traditional Name: 2-[(4-chlorophenyl)thio]acetic acid [(1S)-1-(benzylcarbamoyl)propyl] ester Formula: C19H20ClNO3S MolecularWeight: 377.885

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)OC(=O)CSC2=CC=C(C=C2)Cl

Isomeric SMILES

CC[C@@H](C(=O)NCC1=CC=CC=C1)OC(=O)CSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H20ClNO3S/c1-2-17(19(23)21-12-14-6-4-3-5-7-14)24-18(22)13-25-16-10-8-15(20)9-11-16/h3-11,17H,2,12-13H2,1H3,(H,21,23)/t17-/m0/s1