[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-(2,7-dimethylquinolin-3-yl)methanone

Systemtic Name: [4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-(2,7-dimethylquinolin-3-yl)methanone Openeye Name: [4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-(2,7-dimethyl-3-quinolyl)methanone CAS Name: [4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-(2,7-dimethyl-3-quinolinyl)methanone IUPAC Name: [4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-(2,7-dimethylquinolin-3-yl)methanone Traditional Name: [4-(5-bromopyrimidin-2-yl)piperazino]-(2,7-dimethyl-3-quinolyl)methanone Formula: C20H20BrN5O MolecularWeight: 426.3097

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C(=O)N3CCN(CC3)C4=NC=C(C=N4)Br)C

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)C(=O)N3CCN(CC3)C4=NC=C(C=N4)Br)C

InChI

InChI=1S/C20H20BrN5O/c1-13-3-4-15-10-17(14(2)24-18(15)9-13)19(27)25-5-7-26(8-6-25)20-22-11-16(21)12-23-20/h3-4,9-12H,5-8H2,1-2H3