[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] (2R)-2-(4-chlorophenyl)sulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] (2R)-2-(4-chlorophenyl)sulfanylpropanoate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] (2R)-2-(4-chlorophenyl)sulfanylpropanoate CAS Name: (2R)-2-[(4-chlorophenyl)thio]propanoic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] (2R)-2-(4-chlorophenyl)sulfanylpropanoate Traditional Name: (2R)-2-[(4-chlorophenyl)thio]propionic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C18H18ClNO3S MolecularWeight: 363.85842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NCC1=CC=CC=C1)SC2=CC=C(C=C2)Cl

Isomeric SMILES

C[C@H](C(=O)OCC(=O)NCC1=CC=CC=C1)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H18ClNO3S/c1-13(24-16-9-7-15(19)8-10-16)18(22)23-12-17(21)20-11-14-5-3-2-4-6-14/h2-10,13H,11-12H2,1H3,(H,20,21)/t13-/m1/s1