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

Systemtic Name: methyl (2S)-2-[[4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoate Openeye Name: methyl (2S)-2-[[2-(benzyloxycarbonylamino)-4-methylsulfanyl-butanoyl]amino]propanoate CAS Name: (2S)-2-[[4-(methylthio)-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoate Traditional Name: (2S)-2-[[2-(benzyloxycarbonylamino)-4-(methylthio)butanoyl]amino]propionic acid methyl ester Formula: C17H24N2O5S MolecularWeight: 368.44786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)C(CCSC)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

C[C@@H](C(=O)OC)NC(=O)C(CCSC)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H24N2O5S/c1-12(16(21)23-2)18-15(20)14(9-10-25-3)19-17(22)24-11-13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3,(H,18,20)(H,19,22)/t12-,14?/m0/s1