2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]benzenecarbothioamide

Systemtic Name: 2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]benzenecarbothioamide Openeye Name: 2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]benzenecarbothioamide CAS Name: 2-[methyl-(1-methyl-4-piperidin-1-iumyl)amino]benzenecarbothioamide IUPAC Name: 2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]benzenecarbothioamide Traditional Name: 2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]thiobenzamide Formula: C14H22N3S+ MolecularWeight: 264.40958

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)C2=CC=CC=C2C(=S)N

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C2=CC=CC=C2C(=S)N

InChI

InChI=1S/C14H21N3S/c1-16-9-7-11(8-10-16)17(2)13-6-4-3-5-12(13)14(15)18/h3-6,11H,7-10H2,1-2H3,(H2,15,18)/p+1