methyl 2-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanethioyl]amino]ethanoate

Systemtic Name: methyl 2-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanethioyl]amino]ethanoate Openeye Name: methyl 2-[[(2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanethioyl]amino]acetate CAS Name: 2-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)-1-sulfanylidenepropyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanethioyl]amino]acetate Traditional Name: 2-[[(2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanethioyl]amino]acetic acid methyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=S)C(CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CNC(=S)[C@H](CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H22N2O4S/c1-25-18(23)13-21-19(27)17(12-15-8-4-2-5-9-15)22-20(24)26-14-16-10-6-3-7-11-16/h2-11,17H,12-14H2,1H3,(H,21,27)(H,22,24)/t17-/m0/s1