(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 2-[(3-chlorophenyl)methylsulfanyl]ethanoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 2-[(3-chlorophenyl)methylsulfanyl]ethanoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 2-[(3-chlorophenyl)methylsulfanyl]acetate CAS Name: 2-[(3-chlorophenyl)methylthio]acetic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 2-[(3-chlorophenyl)methylsulfanyl]acetate Traditional Name: 2-[(3-chlorobenzyl)thio]acetic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C17H16ClNO3S MolecularWeight: 349.83184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)N)OC(=O)CSCC2=CC(=CC=C2)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)N)OC(=O)CSCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C17H16ClNO3S/c18-14-8-4-5-12(9-14)10-23-11-15(20)22-16(17(19)21)13-6-2-1-3-7-13/h1-9,16H,10-11H2,(H2,19,21)