N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]thiophene-3-sulfonamide

Systemtic Name: N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]thiophene-3-sulfonamide Openeye Name: N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]thiophene-3-sulfonamide CAS Name: N-[[2-(dimethylamino)-3-pyridin-1-iumyl]methyl]-3-thiophenesulfonamide IUPAC Name: N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]thiophene-3-sulfonamide Traditional Name: N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]thiophene-3-sulfonamide Formula: C12H16N3O2S2+ MolecularWeight: 298.40434

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=CC=[NH+]1)CNS(=O)(=O)C2=CSC=C2

Isomeric SMILES

CN(C)C1=C(C=CC=[NH+]1)CNS(=O)(=O)C2=CSC=C2

InChI

InChI=1S/C12H15N3O2S2/c1-15(2)12-10(4-3-6-13-12)8-14-19(16,17)11-5-7-18-9-11/h3-7,9,14H,8H2,1-2H3/p+1