2-[(3,4-dichlorophenyl)methylsulfanyl]-6-(4-methylphenyl)-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-6-(4-methylphenyl)-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-4-phenyl-6-(p-tolyl)pyridine-3-carbonitrile CAS Name: 2-[(3,4-dichlorophenyl)methylthio]-6-(4-methylphenyl)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-6-(4-methylphenyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-[(3,4-dichlorobenzyl)thio]-4-phenyl-6-(p-tolyl)nicotinonitrile Formula: C26H18Cl2N2S MolecularWeight: 461.40552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C26H18Cl2N2S/c1-17-7-10-20(11-8-17)25-14-21(19-5-3-2-4-6-19)22(15-29)26(30-25)31-16-18-9-12-23(27)24(28)13-18/h2-14H,16H2,1H3