2-(cyanomethylsulfanyl)-6-phenyl-4-(3,4,5-trimethoxyphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-(cyanomethylsulfanyl)-6-phenyl-4-(3,4,5-trimethoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-(cyanomethylsulfanyl)-6-phenyl-4-(3,4,5-trimethoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-(cyanomethylthio)-6-phenyl-4-(3,4,5-trimethoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-(cyanomethylsulfanyl)-6-phenyl-4-(3,4,5-trimethoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-(cyanomethylthio)-6-phenyl-4-(3,4,5-trimethoxyphenyl)nicotinonitrile Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=CC(=NC(=C2C#N)SCC#N)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=CC(=NC(=C2C#N)SCC#N)C3=CC=CC=C3

InChI

InChI=1S/C23H19N3O3S/c1-27-20-11-16(12-21(28-2)22(20)29-3)17-13-19(15-7-5-4-6-8-15)26-23(18(17)14-25)30-10-9-24/h4-8,11-13H,10H2,1-3H3