6-[4-[2-cyclohexyl-2-oxidanylidene-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethyl]piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-[2-cyclohexyl-2-oxidanylidene-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethyl]piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-[2-cyclohexyl-2-oxo-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethyl]piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 6-[4-[2-cyclohexyl-2-oxo-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-[2-cyclohexyl-2-oxo-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethyl]piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-[4-[2-cyclohexyl-2-keto-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethyl]piperazino]nicotinonitrile Formula: C27H33N5O MolecularWeight: 443.58382

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)C(C2CCC3=CC=CC=C3N2)N4CCN(CC4)C5=NC=C(C=C5)C#N

Isomeric SMILES

C1CCC(CC1)C(=O)C(C2CCC3=CC=CC=C3N2)N4CCN(CC4)C5=NC=C(C=C5)C#N

InChI

InChI=1S/C27H33N5O/c28-18-20-10-13-25(29-19-20)31-14-16-32(17-15-31)26(27(33)22-7-2-1-3-8-22)24-12-11-21-6-4-5-9-23(21)30-24/h4-6,9-10,13,19,22,24,26,30H,1-3,7-8,11-12,14-17H2