1-(5-bromanylnaphthalen-1-yl)-3-[4-(4-methylpiperazin-1-yl)quinolin-6-yl]urea hydrochloride

Systemtic Name: 1-(5-bromanylnaphthalen-1-yl)-3-[4-(4-methylpiperazin-1-yl)quinolin-6-yl]urea hydrochloride Openeye Name: 1-(5-bromo-1-naphthyl)-3-[4-(4-methylpiperazin-1-yl)-6-quinolyl]urea hydrochloride CAS Name: 1-(5-bromo-1-naphthalenyl)-3-[4-(4-methyl-1-piperazinyl)-6-quinolinyl]urea hydrochloride IUPAC Name: 1-(5-bromonaphthalen-1-yl)-3-[4-(4-methylpiperazin-1-yl)quinolin-6-yl]urea hydrochloride Traditional Name: 1-(5-bromo-1-naphthyl)-3-[4-(4-methylpiperazino)-6-quinolyl]urea hydrochloride Formula: C25H25BrClN5O MolecularWeight: 526.8559

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C3C=C(C=CC3=NC=C2)NC(=O)NC4=CC=CC5=C4C=CC=C5Br.Cl

Isomeric SMILES

CN1CCN(CC1)C2=C3C=C(C=CC3=NC=C2)NC(=O)NC4=CC=CC5=C4C=CC=C5Br.Cl

InChI

InChI=1S/C25H24BrN5O.ClH/c1-30-12-14-31(15-13-30)24-10-11-27-22-9-8-17(16-20(22)24)28-25(32)29-23-7-3-4-18-19(23)5-2-6-21(18)26;/h2-11,16H,12-15H2,1H3,(H2,28,29,32);1H