2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-1-(3,4-dihydro-2H-quinolin-1-yl)propan-1-one

Systemtic Name: 2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-1-(3,4-dihydro-2H-quinolin-1-yl)propan-1-one Openeye Name: 2-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-1-(3,4-dihydro-2H-quinolin-1-yl)propan-1-one CAS Name: 2-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-1-(3,4-dihydro-2H-quinolin-1-yl)-1-propanone IUPAC Name: 2-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-1-(3,4-dihydro-2H-quinolin-1-yl)propan-1-one Traditional Name: 2-[4-(5-bromo-2-pyridyl)piperazino]-1-(3,4-dihydro-2H-quinolin-1-yl)propan-1-one Formula: C21H25BrN4O MolecularWeight: 429.3534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC2=CC=CC=C21)N3CCN(CC3)C4=NC=C(C=C4)Br

Isomeric SMILES

CC(C(=O)N1CCCC2=CC=CC=C21)N3CCN(CC3)C4=NC=C(C=C4)Br

InChI

InChI=1S/C21H25BrN4O/c1-16(21(27)26-10-4-6-17-5-2-3-7-19(17)26)24-11-13-25(14-12-24)20-9-8-18(22)15-23-20/h2-3,5,7-9,15-16H,4,6,10-14H2,1H3