6-(4-methylpiperazin-4-ium-1-yl)pyridine-3-carbothioamide

Systemtic Name: 6-(4-methylpiperazin-4-ium-1-yl)pyridine-3-carbothioamide Openeye Name: 6-(4-methylpiperazin-4-ium-1-yl)pyridine-3-carbothioamide CAS Name: 6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinecarbothioamide IUPAC Name: 6-(4-methylpiperazin-4-ium-1-yl)pyridine-3-carbothioamide Traditional Name: 6-(4-methylpiperazin-4-ium-1-yl)thionicotinamide Formula: C11H17N4S+ MolecularWeight: 237.34448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N4S/c1-14-4-6-15(7-5-14)10-3-2-9(8-13-10)11(12)16/h2-3,8H,4-7H2,1H3,(H2,12,16)/p+1