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

Systemtic Name: 4-(4-methoxyphenyl)-2-[(2-methylphenyl)methylsulfanyl]-6-phenyl-pyridine-3-carbonitrile Openeye Name: 4-(4-methoxyphenyl)-2-(o-tolylmethylsulfanyl)-6-phenyl-pyridine-3-carbonitrile CAS Name: 4-(4-methoxyphenyl)-2-[(2-methylphenyl)methylthio]-6-phenyl-3-pyridinecarbonitrile IUPAC Name: 4-(4-methoxyphenyl)-2-[(2-methylphenyl)methylsulfanyl]-6-phenylpyridine-3-carbonitrile Traditional Name: 4-(4-methoxyphenyl)-2-[(2-methylbenzyl)thio]-6-phenyl-nicotinonitrile Formula: C27H22N2OS MolecularWeight: 422.54138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)OC)C#N

Isomeric SMILES

CC1=CC=CC=C1CSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)OC)C#N

InChI

InChI=1S/C27H22N2OS/c1-19-8-6-7-11-22(19)18-31-27-25(17-28)24(20-12-14-23(30-2)15-13-20)16-26(29-27)21-9-4-3-5-10-21/h3-16H,18H2,1-2H3