N,N-dimethyl-1-(piperidin-1-ium-1-ylmethyl)-6-sulfanylidene-pyridine-3-sulfonamide

Systemtic Name: N,N-dimethyl-1-(piperidin-1-ium-1-ylmethyl)-6-sulfanylidene-pyridine-3-sulfonamide Openeye Name: N,N-dimethyl-1-(piperidin-1-ium-1-ylmethyl)-6-thioxo-pyridine-3-sulfonamide CAS Name: N,N-dimethyl-1-(1-piperidin-1-iumylmethyl)-6-sulfanylidene-3-pyridinesulfonamide IUPAC Name: N,N-dimethyl-1-(piperidin-1-ium-1-ylmethyl)-6-sulfanylidenepyridine-3-sulfonamide Traditional Name: N,N-dimethyl-1-(piperidin-1-ium-1-ylmethyl)-6-thioxo-pyridine-3-sulfonamide Formula: C13H22N3O2S2+ MolecularWeight: 316.46268

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CN(C(=S)C=C1)C[NH+]2CCCCC2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CN(C(=S)C=C1)C[NH+]2CCCCC2

InChI

InChI=1S/C13H21N3O2S2/c1-14(2)20(17,18)12-6-7-13(19)16(10-12)11-15-8-4-3-5-9-15/h6-7,10H,3-5,8-9,11H2,1-2H3/p+1