ethyl (2S,6S)-6-cyano-1-(4-methylphenyl)sulfonyl-2-phenyl-3,6-dihydro-2H-pyridine-5-carboxylate

Systemtic Name: ethyl (2S,6S)-6-cyano-1-(4-methylphenyl)sulfonyl-2-phenyl-3,6-dihydro-2H-pyridine-5-carboxylate Openeye Name: ethyl (2S,6S)-6-cyano-2-phenyl-1-(p-tolylsulfonyl)-3,6-dihydro-2H-pyridine-5-carboxylate CAS Name: (2S,6S)-6-cyano-1-(4-methylphenyl)sulfonyl-2-phenyl-3,6-dihydro-2H-pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (2S,6S)-6-cyano-1-(4-methylphenyl)sulfonyl-2-phenyl-3,6-dihydro-2H-pyridine-5-carboxylate Traditional Name: (2S,6S)-6-cyano-2-phenyl-1-tosyl-3,6-dihydro-2H-pyridine-5-carboxylic acid ethyl ester Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CCC(N(C1C#N)S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC[C@H](N([C@@H]1C#N)S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O4S/c1-3-28-22(25)19-13-14-20(17-7-5-4-6-8-17)24(21(19)15-23)29(26,27)18-11-9-16(2)10-12-18/h4-13,20-21H,3,14H2,1-2H3/t20-,21+/m0/s1