4-bromanyl-1-methyl-N-(4-methylpiperazin-4-ium-1-yl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-1-methyl-N-(4-methylpiperazin-4-ium-1-yl)pyrazole-3-carboxamide Openeye Name: 4-bromo-1-methyl-N-(4-methylpiperazin-4-ium-1-yl)pyrazole-3-carboxamide CAS Name: 4-bromo-1-methyl-N-(4-methyl-1-piperazin-4-iumyl)-3-pyrazolecarboxamide IUPAC Name: 4-bromo-1-methyl-N-(4-methylpiperazin-4-ium-1-yl)pyrazole-3-carboxamide Traditional Name: 4-bromo-1-methyl-N-(4-methylpiperazin-4-ium-1-yl)pyrazole-3-carboxamide Formula: C10H17BrN5O+ MolecularWeight: 303.17888

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C2=NN(C=C2Br)C

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)C2=NN(C=C2Br)C

InChI

InChI=1S/C10H16BrN5O/c1-14-3-5-16(6-4-14)13-10(17)9-8(11)7-15(2)12-9/h7H,3-6H2,1-2H3,(H,13,17)/p+1