2-(4-methylpiperazin-1-yl)-4-(2-phenylethynyl)pyrimidine dihydrobromide

Systemtic Name: 2-(4-methylpiperazin-1-yl)-4-(2-phenylethynyl)pyrimidine dihydrobromide Openeye Name: 2-(4-methylpiperazin-1-yl)-4-(2-phenylethynyl)pyrimidine dihydrobromide CAS Name: 2-(4-methyl-1-piperazinyl)-4-(2-phenylethynyl)pyrimidine dihydrobromide IUPAC Name: 2-(4-methylpiperazin-1-yl)-4-(2-phenylethynyl)pyrimidine dihydrobromide Traditional Name: 2-(4-methylpiperazino)-4-(2-phenylethynyl)pyrimidine dihydrobromide Formula: C17H20Br2N4 MolecularWeight: 440.1755

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=CC(=N2)C#CC3=CC=CC=C3.Br.Br

Isomeric SMILES

CN1CCN(CC1)C2=NC=CC(=N2)C#CC3=CC=CC=C3.Br.Br

InChI

InChI=1S/C17H18N4.2BrH/c1-20-11-13-21(14-12-20)17-18-10-9-16(19-17)8-7-15-5-3-2-4-6-15;;/h2-6,9-10H,11-14H2,1H3;2*1H