N-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]quinolin-2-amine hydrobromide

Systemtic Name: N-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]quinolin-2-amine hydrobromide Openeye Name: N-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]quinolin-2-amine hydrobromide CAS Name: N-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-2-quinolinamine hydrobromide IUPAC Name: N-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]quinolin-2-amine hydrobromide Traditional Name: 4-[4-(2-pyrimidyl)piperazino]butyl-(2-quinolyl)amine hydrobromide Formula: C21H27BrN6 MolecularWeight: 443.38328

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCNC2=NC3=CC=CC=C3C=C2)C4=NC=CC=N4.Br

Isomeric SMILES

C1CN(CCN1CCCCNC2=NC3=CC=CC=C3C=C2)C4=NC=CC=N4.Br

InChI

InChI=1S/C21H26N6.BrH/c1-2-7-19-18(6-1)8-9-20(25-19)22-10-3-4-13-26-14-16-27(17-15-26)21-23-11-5-12-24-21;/h1-2,5-9,11-12H,3-4,10,13-17H2,(H,22,25);1H