1-cyclohexyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)-2-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone

Systemtic Name: 1-cyclohexyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)-2-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone Openeye Name: 1-cyclohexyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)-2-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone CAS Name: 1-cyclohexyl-2-[4-(2-pyrimidinyl)-1-piperazinyl]-2-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone IUPAC Name: 1-cyclohexyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)-2-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone Traditional Name: 1-cyclohexyl-2-[4-(2-pyrimidyl)piperazino]-2-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone Formula: C25H33N5O MolecularWeight: 419.56242

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)C(C2CCC3=CC=CC=C3N2)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

C1CCC(CC1)C(=O)C(C2CCC3=CC=CC=C3N2)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C25H33N5O/c31-24(20-8-2-1-3-9-20)23(22-12-11-19-7-4-5-10-21(19)28-22)29-15-17-30(18-16-29)25-26-13-6-14-27-25/h4-7,10,13-14,20,22-23,28H,1-3,8-9,11-12,15-18H2