methyl 2-[[4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]ethanoate

Systemtic Name: methyl 2-[[4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]ethanoate Openeye Name: methyl 2-[[2-(benzyloxycarbonylamino)-4-methylsulfanyl-butanoyl]amino]acetate CAS Name: 2-[[4-(methylthio)-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]acetate Traditional Name: 2-[[2-(benzyloxycarbonylamino)-4-(methylthio)butanoyl]amino]acetic acid methyl ester Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O5S/c1-22-14(19)10-17-15(20)13(8-9-24-2)18-16(21)23-11-12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3,(H,17,20)(H,18,21)