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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)Cl)C#N

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)Cl)C#N

InChI

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