2-[(2-chlorophenyl)methylsulfanyl]-4-(4-methoxyphenyl)-6-(4-methylphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanyl]-4-(4-methoxyphenyl)-6-(4-methylphenyl)pyridine-3-carbonitrile Openeye Name: 2-[(2-chlorophenyl)methylsulfanyl]-4-(4-methoxyphenyl)-6-(p-tolyl)pyridine-3-carbonitrile CAS Name: 2-[(2-chlorophenyl)methylthio]-4-(4-methoxyphenyl)-6-(4-methylphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-[(2-chlorophenyl)methylsulfanyl]-4-(4-methoxyphenyl)-6-(4-methylphenyl)pyridine-3-carbonitrile Traditional Name: 2-[(2-chlorobenzyl)thio]-4-(4-methoxyphenyl)-6-(p-tolyl)nicotinonitrile Formula: C27H21ClN2OS MolecularWeight: 456.98644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=C(C=C3)OC)C#N)SCC4=CC=CC=C4Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=C(C=C3)OC)C#N)SCC4=CC=CC=C4Cl

InChI

InChI=1S/C27H21ClN2OS/c1-18-7-9-20(10-8-18)26-15-23(19-11-13-22(31-2)14-12-19)24(16-29)27(30-26)32-17-21-5-3-4-6-25(21)28/h3-15H,17H2,1-2H3