2-cyclopentyl-N-[4-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)quinolin-6-yl]-2-phenyl-ethanamide

Systemtic Name: 2-cyclopentyl-N-[4-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)quinolin-6-yl]-2-phenyl-ethanamide Openeye Name: 2-cyclopentyl-N-[4-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)-6-quinolyl]-2-phenyl-acetamide CAS Name: 2-cyclopentyl-N-[4-methyl-2-[4-(2-pyrimidinyl)-1-piperazinyl]-6-quinolinyl]-2-phenylacetamide IUPAC Name: 2-cyclopentyl-N-[4-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)quinolin-6-yl]-2-phenylacetamide Traditional Name: 2-cyclopentyl-N-[4-methyl-2-[4-(2-pyrimidyl)piperazino]-6-quinolyl]-2-phenyl-acetamide Formula: C31H34N6O MolecularWeight: 506.64126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)C(C3CCCC3)C4=CC=CC=C4)N5CCN(CC5)C6=NC=CC=N6

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)C(C3CCCC3)C4=CC=CC=C4)N5CCN(CC5)C6=NC=CC=N6

InChI

InChI=1S/C31H34N6O/c1-22-20-28(36-16-18-37(19-17-36)31-32-14-7-15-33-31)35-27-13-12-25(21-26(22)27)34-30(38)29(24-10-5-6-11-24)23-8-3-2-4-9-23/h2-4,7-9,12-15,20-21,24,29H,5-6,10-11,16-19H2,1H3,(H,34,38)