(4R)-4-cyano-1-(4-methylphenyl)sulfonyl-N-[(2S)-1-oxidanylidene-3-phenyl-propan-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: (4R)-4-cyano-1-(4-methylphenyl)sulfonyl-N-[(2S)-1-oxidanylidene-3-phenyl-propan-2-yl]pyrrolidine-2-carboxamide Openeye Name: (4R)-N-[(1S)-1-benzyl-2-oxo-ethyl]-4-cyano-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (4R)-4-cyano-1-(4-methylphenyl)sulfonyl-N-[(2S)-1-oxo-3-phenylpropan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: (4R)-4-cyano-1-(4-methylphenyl)sulfonyl-N-[(2S)-1-oxo-3-phenylpropan-2-yl]pyrrolidine-2-carboxamide Traditional Name: (4R)-N-[(1S)-1-benzyl-2-keto-ethyl]-4-cyano-1-tosyl-pyrrolidine-2-carboxamide Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2C(=O)NC(CC3=CC=CC=C3)C=O)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C[C@@H](CC2C(=O)N[C@@H](CC3=CC=CC=C3)C=O)C#N

InChI

InChI=1S/C22H23N3O4S/c1-16-7-9-20(10-8-16)30(28,29)25-14-18(13-23)12-21(25)22(27)24-19(15-26)11-17-5-3-2-4-6-17/h2-10,15,18-19,21H,11-12,14H2,1H3,(H,24,27)/t18-,19-,21?/m0/s1