(4-pyrimidin-2-ylpiperazin-1-yl)-[2-(3,4,5-trimethoxyphenyl)quinolin-4-yl]methanone

Systemtic Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[2-(3,4,5-trimethoxyphenyl)quinolin-4-yl]methanone Openeye Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[2-(3,4,5-trimethoxyphenyl)-4-quinolyl]methanone CAS Name: [4-(2-pyrimidinyl)-1-piperazinyl]-[2-(3,4,5-trimethoxyphenyl)-4-quinolinyl]methanone IUPAC Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[2-(3,4,5-trimethoxyphenyl)quinolin-4-yl]methanone Traditional Name: [4-(2-pyrimidyl)piperazino]-[2-(3,4,5-trimethoxyphenyl)-4-quinolyl]methanone Formula: C27H27N5O4 MolecularWeight: 485.53438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C27H27N5O4/c1-34-23-15-18(16-24(35-2)25(23)36-3)22-17-20(19-7-4-5-8-21(19)30-22)26(33)31-11-13-32(14-12-31)27-28-9-6-10-29-27/h4-10,15-17H,11-14H2,1-3H3