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

Systemtic Name: 6-(4-chlorophenyl)-4-phenyl-2-(2-piperidin-1-ylethylsulfanyl)pyridine-3-carbonitrile Openeye Name: 6-(4-chlorophenyl)-4-phenyl-2-[2-(1-piperidyl)ethylsulfanyl]pyridine-3-carbonitrile CAS Name: 6-(4-chlorophenyl)-4-phenyl-2-[2-(1-piperidinyl)ethylthio]-3-pyridinecarbonitrile IUPAC Name: 6-(4-chlorophenyl)-4-phenyl-2-(2-piperidin-1-ylethylsulfanyl)pyridine-3-carbonitrile Traditional Name: 6-(4-chlorophenyl)-4-phenyl-2-(2-piperidinoethylthio)nicotinonitrile Formula: C25H24ClN3S MolecularWeight: 433.99616

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCSC2=C(C(=CC(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4)C#N

Isomeric SMILES

C1CCN(CC1)CCSC2=C(C(=CC(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4)C#N

InChI

InChI=1S/C25H24ClN3S/c26-21-11-9-20(10-12-21)24-17-22(19-7-3-1-4-8-19)23(18-27)25(28-24)30-16-15-29-13-5-2-6-14-29/h1,3-4,7-12,17H,2,5-6,13-16H2