6-(4-methoxyphenyl)-2-phenyl-4-(2-piperidin-1-ylethylsulfanyl)pyridine-3-carbonitrile

Systemtic Name: 6-(4-methoxyphenyl)-2-phenyl-4-(2-piperidin-1-ylethylsulfanyl)pyridine-3-carbonitrile Openeye Name: 6-(4-methoxyphenyl)-2-phenyl-4-[2-(1-piperidyl)ethylsulfanyl]pyridine-3-carbonitrile CAS Name: 6-(4-methoxyphenyl)-2-phenyl-4-[2-(1-piperidinyl)ethylthio]-3-pyridinecarbonitrile IUPAC Name: 6-(4-methoxyphenyl)-2-phenyl-4-(2-piperidin-1-ylethylsulfanyl)pyridine-3-carbonitrile Traditional Name: 6-(4-methoxyphenyl)-2-phenyl-4-(2-piperidinoethylthio)nicotinonitrile Formula: C26H27N3OS MolecularWeight: 429.57708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)SCCN3CCCCC3)C#N)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)SCCN3CCCCC3)C#N)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3OS/c1-30-22-12-10-20(11-13-22)24-18-25(31-17-16-29-14-6-3-7-15-29)23(19-27)26(28-24)21-8-4-2-5-9-21/h2,4-5,8-13,18H,3,6-7,14-17H2,1H3