methyl (2S)-4-methylsulfanyl-2-[(4-phenylmethoxyphenyl)carbonylamino]butanoate

Systemtic Name: methyl (2S)-4-methylsulfanyl-2-[(4-phenylmethoxyphenyl)carbonylamino]butanoate Openeye Name: methyl (2S)-2-[(4-benzyloxybenzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-4-(methylthio)-2-[[oxo-(4-phenylmethoxyphenyl)methyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-4-methylsulfanyl-2-[(4-phenylmethoxybenzoyl)amino]butanoate Traditional Name: (2S)-2-[(4-benzoxybenzoyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO4S/c1-24-20(23)18(12-13-26-2)21-19(22)16-8-10-17(11-9-16)25-14-15-6-4-3-5-7-15/h3-11,18H,12-14H2,1-2H3,(H,21,22)/t18-/m0/s1