methyl (2S)-2-[2-[(4-chlorophenyl)methylsulfanyl]ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[2-[(4-chlorophenyl)methylsulfanyl]ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[2-[(4-chlorophenyl)methylsulfanyl]acetyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[2-[(4-chlorophenyl)methylthio]-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-[(4-chlorophenyl)methylsulfanyl]acetyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-[(4-chlorobenzyl)thio]acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C19H20ClNO3S MolecularWeight: 377.885

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)CSCC2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CSCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H20ClNO3S/c1-24-19(23)17(11-14-5-3-2-4-6-14)21-18(22)13-25-12-15-7-9-16(20)10-8-15/h2-10,17H,11-13H2,1H3,(H,21,22)/t17-/m0/s1