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

Systemtic Name: 2-(4-chlorophenyl)-N-[4-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)quinolin-6-yl]ethanamide Openeye Name: 2-(4-chlorophenyl)-N-[4-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)-6-quinolyl]acetamide CAS Name: 2-(4-chlorophenyl)-N-[4-methyl-2-[4-(2-pyrimidinyl)-1-piperazinyl]-6-quinolinyl]acetamide IUPAC Name: 2-(4-chlorophenyl)-N-[4-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)quinolin-6-yl]acetamide Traditional Name: 2-(4-chlorophenyl)-N-[4-methyl-2-[4-(2-pyrimidyl)piperazino]-6-quinolyl]acetamide Formula: C26H25ClN6O MolecularWeight: 472.9693

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CC3=CC=C(C=C3)Cl)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CC3=CC=C(C=C3)Cl)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C26H25ClN6O/c1-18-15-24(32-11-13-33(14-12-32)26-28-9-2-10-29-26)31-23-8-7-21(17-22(18)23)30-25(34)16-19-3-5-20(27)6-4-19/h2-10,15,17H,11-14,16H2,1H3,(H,30,34)