4-(2-methoxyphenyl)-6-phenyl-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carbonitrile

Systemtic Name: 4-(2-methoxyphenyl)-6-phenyl-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carbonitrile Openeye Name: 4-(2-methoxyphenyl)-6-phenyl-2-(4-pyridylmethylsulfanyl)pyridine-3-carbonitrile CAS Name: 4-(2-methoxyphenyl)-6-phenyl-2-(pyridin-4-ylmethylthio)-3-pyridinecarbonitrile IUPAC Name: 4-(2-methoxyphenyl)-6-phenyl-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carbonitrile Traditional Name: 4-(2-methoxyphenyl)-6-phenyl-2-(4-pyridylmethylthio)nicotinonitrile Formula: C25H19N3OS MolecularWeight: 409.50286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CC(=NC(=C2C#N)SCC3=CC=NC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C2=CC(=NC(=C2C#N)SCC3=CC=NC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H19N3OS/c1-29-24-10-6-5-9-20(24)21-15-23(19-7-3-2-4-8-19)28-25(22(21)16-26)30-17-18-11-13-27-14-12-18/h2-15H,17H2,1H3