2-[4-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[[4-[4-[2-(p-tolyl)ethyl]piperidine-1-carbonyl]-1-piperidyl]sulfonyl]benzonitrile CAS Name: 2-[[4-[[4-[2-(4-methylphenyl)ethyl]-1-piperidinyl]-oxomethyl]-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[4-[2-(4-methylphenyl)ethyl]piperidine-1-carbonyl]piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[4-[2-(p-tolyl)ethyl]piperidine-1-carbonyl]piperidino]sulfonylbenzonitrile Formula: C27H33N3O3S MolecularWeight: 479.63422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

CC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C27H33N3O3S/c1-21-6-8-22(9-7-21)10-11-23-12-16-29(17-13-23)27(31)24-14-18-30(19-15-24)34(32,33)26-5-3-2-4-25(26)20-28/h2-9,23-24H,10-19H2,1H3