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

Systemtic Name: 4-(2-methoxyphenyl)-6-(4-methylphenyl)-2-(2-piperidin-1-ylethylsulfanyl)pyridine-3-carbonitrile Openeye Name: 4-(2-methoxyphenyl)-2-[2-(1-piperidyl)ethylsulfanyl]-6-(p-tolyl)pyridine-3-carbonitrile CAS Name: 4-(2-methoxyphenyl)-6-(4-methylphenyl)-2-[2-(1-piperidinyl)ethylthio]-3-pyridinecarbonitrile IUPAC Name: 4-(2-methoxyphenyl)-6-(4-methylphenyl)-2-(2-piperidin-1-ylethylsulfanyl)pyridine-3-carbonitrile Traditional Name: 4-(2-methoxyphenyl)-2-(2-piperidinoethylthio)-6-(p-tolyl)nicotinonitrile Formula: C27H29N3OS MolecularWeight: 443.60366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3OC)C#N)SCCN4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3OC)C#N)SCCN4CCCCC4

InChI

InChI=1S/C27H29N3OS/c1-20-10-12-21(13-11-20)25-18-23(22-8-4-5-9-26(22)31-2)24(19-28)27(29-25)32-17-16-30-14-6-3-7-15-30/h4-5,8-13,18H,3,6-7,14-17H2,1-2H3