2-(cyanomethylsulfanyl)-6-cyclopropyl-4-(4-methoxyphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-(cyanomethylsulfanyl)-6-cyclopropyl-4-(4-methoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-(cyanomethylsulfanyl)-6-cyclopropyl-4-(4-methoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-(cyanomethylthio)-6-cyclopropyl-4-(4-methoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-(cyanomethylsulfanyl)-6-cyclopropyl-4-(4-methoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-(cyanomethylthio)-6-cyclopropyl-4-(4-methoxyphenyl)nicotinonitrile Formula: C18H15N3OS MolecularWeight: 321.3962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC#N)C3CC3

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC#N)C3CC3

InChI

InChI=1S/C18H15N3OS/c1-22-14-6-4-12(5-7-14)15-10-17(13-2-3-13)21-18(16(15)11-20)23-9-8-19/h4-7,10,13H,2-3,9H2,1H3