methyl (2S)-2-(phenylmethoxycarbonylamino)-4-phenylsulfanyl-pent-4-enoate

Systemtic Name: methyl (2S)-2-(phenylmethoxycarbonylamino)-4-phenylsulfanyl-pent-4-enoate Openeye Name: methyl (2S)-2-(benzyloxycarbonylamino)-4-phenylsulfanyl-pent-4-enoate CAS Name: (2S)-2-(phenylmethoxycarbonylamino)-4-(phenylthio)-4-pentenoic acid methyl ester IUPAC Name: methyl (2S)-2-(phenylmethoxycarbonylamino)-4-phenylsulfanylpent-4-enoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-4-(phenylthio)pent-4-enoic acid methyl ester Formula: C20H21NO4S MolecularWeight: 371.45004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(=C)SC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@H](CC(=C)SC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H21NO4S/c1-15(26-17-11-7-4-8-12-17)13-18(19(22)24-2)21-20(23)25-14-16-9-5-3-6-10-16/h3-12,18H,1,13-14H2,2H3,(H,21,23)/t18-/m0/s1