methyl 4-[[[(2S)-2-phenyl-2-phenylsulfanyl-ethanoyl]amino]methyl]benzoate

Systemtic Name: methyl 4-[[[(2S)-2-phenyl-2-phenylsulfanyl-ethanoyl]amino]methyl]benzoate Openeye Name: methyl 4-[[[(2S)-2-phenyl-2-phenylsulfanyl-acetyl]amino]methyl]benzoate CAS Name: 4-[[[(2S)-1-oxo-2-phenyl-2-(phenylthio)ethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[(2S)-2-phenyl-2-phenylsulfanylacetyl]amino]methyl]benzoate Traditional Name: 4-[[[(2S)-2-phenyl-2-(phenylthio)acetyl]amino]methyl]benzoic acid methyl ester Formula: C23H21NO3S MolecularWeight: 391.48274

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C(C2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)[C@H](C2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C23H21NO3S/c1-27-23(26)19-14-12-17(13-15-19)16-24-22(25)21(18-8-4-2-5-9-18)28-20-10-6-3-7-11-20/h2-15,21H,16H2,1H3,(H,24,25)/t21-/m0/s1