2-(2-ethylsulfonylethylsulfanyl)-6-(4-methylphenyl)-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-(2-ethylsulfonylethylsulfanyl)-6-(4-methylphenyl)-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-(2-ethylsulfonylethylsulfanyl)-4-phenyl-6-(p-tolyl)pyridine-3-carbonitrile CAS Name: 2-(2-ethylsulfonylethylthio)-6-(4-methylphenyl)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-(2-ethylsulfonylethylsulfanyl)-6-(4-methylphenyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-(2-esylethylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile Formula: C23H22N2O2S2 MolecularWeight: 422.56298

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CCSC1=C(C(=CC(=N1)C2=CC=C(C=C2)C)C3=CC=CC=C3)C#N

Isomeric SMILES

CCS(=O)(=O)CCSC1=C(C(=CC(=N1)C2=CC=C(C=C2)C)C3=CC=CC=C3)C#N

InChI

InChI=1S/C23H22N2O2S2/c1-3-29(26,27)14-13-28-23-21(16-24)20(18-7-5-4-6-8-18)15-22(25-23)19-11-9-17(2)10-12-19/h4-12,15H,3,13-14H2,1-2H3