N-[4-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)quinolin-6-yl]-4-propyl-cyclohexane-1-carboxamide

Systemtic Name: N-[4-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)quinolin-6-yl]-4-propyl-cyclohexane-1-carboxamide Openeye Name: N-[4-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)-6-quinolyl]-4-propyl-cyclohexanecarboxamide CAS Name: N-[4-methyl-2-[4-(2-pyrimidinyl)-1-piperazinyl]-6-quinolinyl]-4-propyl-1-cyclohexanecarboxamide IUPAC Name: N-[4-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)quinolin-6-yl]-4-propylcyclohexane-1-carboxamide Traditional Name: N-[4-methyl-2-[4-(2-pyrimidyl)piperazino]-6-quinolyl]-4-propyl-cyclohexanecarboxamide Formula: C28H36N6O MolecularWeight: 472.62504

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)C(=O)NC2=CC3=C(C=C2)N=C(C=C3C)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CCCC1CCC(CC1)C(=O)NC2=CC3=C(C=C2)N=C(C=C3C)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C28H36N6O/c1-3-5-21-6-8-22(9-7-21)27(35)31-23-10-11-25-24(19-23)20(2)18-26(32-25)33-14-16-34(17-15-33)28-29-12-4-13-30-28/h4,10-13,18-19,21-22H,3,5-9,14-17H2,1-2H3,(H,31,35)