[6-bromanyl-2-(4-ethoxyphenyl)quinolin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [6-bromanyl-2-(4-ethoxyphenyl)quinolin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [6-bromo-2-(4-ethoxyphenyl)-4-quinolyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [6-bromo-2-(4-ethoxyphenyl)-4-quinolinyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [6-bromo-2-(4-ethoxyphenyl)quinolin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (6-bromo-2-p-phenetyl-4-quinolyl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C26H24BrN5O2 MolecularWeight: 518.40506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C26H24BrN5O2/c1-2-34-20-7-4-18(5-8-20)24-17-22(21-16-19(27)6-9-23(21)30-24)25(33)31-12-14-32(15-13-31)26-28-10-3-11-29-26/h3-11,16-17H,2,12-15H2,1H3