(4-cyclohexylpiperazin-1-yl)-[6-methyl-2-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyridin-3-yl]methanone

Systemtic Name: (4-cyclohexylpiperazin-1-yl)-[6-methyl-2-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyridin-3-yl]methanone Openeye Name: (4-cyclohexylpiperazin-1-yl)-[6-methyl-2-[1-(2-pyridylmethyl)-4-piperidyl]-3-pyridyl]methanone CAS Name: (4-cyclohexyl-1-piperazinyl)-[6-methyl-2-[1-(2-pyridinylmethyl)-4-piperidinyl]-3-pyridinyl]methanone IUPAC Name: (4-cyclohexylpiperazin-1-yl)-[6-methyl-2-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyridin-3-yl]methanone Traditional Name: (4-cyclohexylpiperazino)-[6-methyl-2-[1-(2-pyridylmethyl)-4-piperidyl]-3-pyridyl]methanone Formula: C28H39N5O MolecularWeight: 461.64216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)N2CCN(CC2)C3CCCCC3)C4CCN(CC4)CC5=CC=CC=N5

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)N2CCN(CC2)C3CCCCC3)C4CCN(CC4)CC5=CC=CC=N5

InChI

InChI=1S/C28H39N5O/c1-22-10-11-26(28(34)33-19-17-32(18-20-33)25-8-3-2-4-9-25)27(30-22)23-12-15-31(16-13-23)21-24-7-5-6-14-29-24/h5-7,10-11,14,23,25H,2-4,8-9,12-13,15-21H2,1H3