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

Systemtic Name: 4,6-bis(4-methoxyphenyl)-2-[(2-methylphenyl)methylsulfanyl]pyridine-3-carbonitrile Openeye Name: 4,6-bis(4-methoxyphenyl)-2-(o-tolylmethylsulfanyl)pyridine-3-carbonitrile CAS Name: 4,6-bis(4-methoxyphenyl)-2-[(2-methylphenyl)methylthio]-3-pyridinecarbonitrile IUPAC Name: 4,6-bis(4-methoxyphenyl)-2-[(2-methylphenyl)methylsulfanyl]pyridine-3-carbonitrile Traditional Name: 4,6-bis(4-methoxyphenyl)-2-[(2-methylbenzyl)thio]nicotinonitrile Formula: C28H24N2O2S MolecularWeight: 452.56736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H24N2O2S/c1-19-6-4-5-7-22(19)18-33-28-26(17-29)25(20-8-12-23(31-2)13-9-20)16-27(30-28)21-10-14-24(32-3)15-11-21/h4-16H,18H2,1-3H3