2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]pyridine-3-carbothioamide

Systemtic Name: 2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]pyridine-3-carbothioamide Openeye Name: 2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]pyridine-3-carbothioamide CAS Name: 2-[methyl-(1-methyl-4-piperidin-1-iumyl)amino]-3-pyridinecarbothioamide IUPAC Name: 2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]pyridine-3-carbothioamide Traditional Name: 2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]thionicotinamide Formula: C13H21N4S+ MolecularWeight: 265.39764

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)C2=C(C=CC=N2)C(=S)N

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C2=C(C=CC=N2)C(=S)N

InChI

InChI=1S/C13H20N4S/c1-16-8-5-10(6-9-16)17(2)13-11(12(14)18)4-3-7-15-13/h3-4,7,10H,5-6,8-9H2,1-2H3,(H2,14,18)/p+1