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

Systemtic Name: 1-methyl-N-(4-methylpiperazin-4-ium-1-yl)carbothioyl-pyrazole-3-carboxamide Openeye Name: 1-methyl-N-(4-methylpiperazin-4-ium-1-carbothioyl)pyrazole-3-carboxamide CAS Name: 1-methyl-N-[(4-methyl-1-piperazin-4-iumyl)-sulfanylidenemethyl]-3-pyrazolecarboxamide IUPAC Name: 1-methyl-N-(4-methylpiperazin-4-ium-1-carbothioyl)pyrazole-3-carboxamide Traditional Name: 1-methyl-N-(4-methylpiperazin-4-ium-1-carbothioyl)pyrazole-3-carboxamide Formula: C11H18N5OS+ MolecularWeight: 268.35852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H17N5OS/c1-14-5-7-16(8-6-14)11(18)12-10(17)9-3-4-15(2)13-9/h3-4H,5-8H2,1-2H3,(H,12,17,18)/p+1