N-[(2S)-1-[(3-methylsulfonylphenyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-1-[(3-methylsulfonylphenyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-1-benzyl-2-(3-methylsulfonylanilino)-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[(2S)-1-(3-methylsulfonylanilino)-1-oxo-3-phenylpropan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-1-(3-methylsulfonylanilino)-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-keto-2-(3-mesylanilino)ethyl]-2-furamide Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CO3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C21H20N2O5S/c1-29(26,27)17-10-5-9-16(14-17)22-20(24)18(13-15-7-3-2-4-8-15)23-21(25)19-11-6-12-28-19/h2-12,14,18H,13H2,1H3,(H,22,24)(H,23,25)/t18-/m0/s1