methyl 4-methylsulfanyl-2-[[3-oxidanyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoate

Systemtic Name: methyl 4-methylsulfanyl-2-[[3-oxidanyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoate Openeye Name: methyl 2-[[2-(benzyloxycarbonylamino)-3-hydroxy-propanoyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[3-hydroxy-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[[3-hydroxy-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[2-(benzyloxycarbonylamino)-3-hydroxy-propanoyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C17H24N2O6S MolecularWeight: 384.44726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)C(CO)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)C(CO)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H24N2O6S/c1-24-16(22)13(8-9-26-2)18-15(21)14(10-20)19-17(23)25-11-12-6-4-3-5-7-12/h3-7,13-14,20H,8-11H2,1-2H3,(H,18,21)(H,19,23)