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

Systemtic Name: 6-cyclopropyl-4-(4-methoxyphenyl)-2-(phenylmethylsulfanyl)pyridine-3-carbonitrile Openeye Name: 2-benzylsulfanyl-6-cyclopropyl-4-(4-methoxyphenyl)pyridine-3-carbonitrile CAS Name: 6-cyclopropyl-4-(4-methoxyphenyl)-2-(phenylmethylthio)-3-pyridinecarbonitrile IUPAC Name: 2-benzylsulfanyl-6-cyclopropyl-4-(4-methoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-(benzylthio)-6-cyclopropyl-4-(4-methoxyphenyl)nicotinonitrile Formula: C23H20N2OS MolecularWeight: 372.4827

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC3=CC=CC=C3)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC3=CC=CC=C3)C4CC4

InChI

InChI=1S/C23H20N2OS/c1-26-19-11-9-17(10-12-19)20-13-22(18-7-8-18)25-23(21(20)14-24)27-15-16-5-3-2-4-6-16/h2-6,9-13,18H,7-8,15H2,1H3