2-(cyanomethylsulfanyl)-4,6-bis(4-methoxyphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-(cyanomethylsulfanyl)-4,6-bis(4-methoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-(cyanomethylsulfanyl)-4,6-bis(4-methoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-(cyanomethylthio)-4,6-bis(4-methoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-(cyanomethylsulfanyl)-4,6-bis(4-methoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-(cyanomethylthio)-4,6-bis(4-methoxyphenyl)nicotinonitrile Formula: C22H17N3O2S MolecularWeight: 387.45428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC#N)C3=CC=C(C=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC#N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H17N3O2S/c1-26-17-7-3-15(4-8-17)19-13-21(16-5-9-18(27-2)10-6-16)25-22(20(19)14-24)28-12-11-23/h3-10,13H,12H2,1-2H3