5-bromanyl-2-(4-methylpiperazin-4-ium-1-yl)pyrimidine

Systemtic Name: 5-bromanyl-2-(4-methylpiperazin-4-ium-1-yl)pyrimidine Openeye Name: 5-bromo-2-(4-methylpiperazin-4-ium-1-yl)pyrimidine CAS Name: 5-bromo-2-(4-methyl-1-piperazin-4-iumyl)pyrimidine IUPAC Name: 5-bromo-2-(4-methylpiperazin-4-ium-1-yl)pyrimidine Traditional Name: 5-bromo-2-(4-methylpiperazin-4-ium-1-yl)pyrimidine Formula: C9H14BrN4+ MolecularWeight: 258.13826

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(C=N2)Br

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(C=N2)Br

InChI

InChI=1S/C9H13BrN4/c1-13-2-4-14(5-3-13)9-11-6-8(10)7-12-9/h6-7H,2-5H2,1H3/p+1