6-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-N-pyridin-2-yl-pyridin-1-ium-3-sulfonamide

Systemtic Name: 6-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-N-pyridin-2-yl-pyridin-1-ium-3-sulfonamide Openeye Name: 6-[methyl-[(3-methyl-2-thienyl)methyl]amino]-N-(2-pyridyl)pyridin-1-ium-3-sulfonamide CAS Name: 6-[methyl-[(3-methyl-2-thiophenyl)methyl]amino]-N-(2-pyridinyl)-3-pyridin-1-iumsulfonamide IUPAC Name: 6-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-N-pyridin-2-ylpyridin-1-ium-3-sulfonamide Traditional Name: 6-[methyl-[(3-methyl-2-thienyl)methyl]amino]-N-(2-pyridyl)pyridin-1-ium-3-sulfonamide Formula: C17H19N4O2S2+ MolecularWeight: 375.48836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(C)C2=[NH+]C=C(C=C2)S(=O)(=O)NC3=CC=CC=N3

Isomeric SMILES

CC1=C(SC=C1)CN(C)C2=[NH+]C=C(C=C2)S(=O)(=O)NC3=CC=CC=N3

InChI

InChI=1S/C17H18N4O2S2/c1-13-8-10-24-15(13)12-21(2)17-7-6-14(11-19-17)25(22,23)20-16-5-3-4-9-18-16/h3-11H,12H2,1-2H3,(H,18,20)/p+1