N-methyl-2-(4-propan-2-ylpiperazin-4-ium-1-yl)pyridin-1-ium-3-sulfonamide

Systemtic Name: N-methyl-2-(4-propan-2-ylpiperazin-4-ium-1-yl)pyridin-1-ium-3-sulfonamide Openeye Name: 2-(4-isopropylpiperazin-4-ium-1-yl)-N-methyl-pyridin-1-ium-3-sulfonamide CAS Name: N-methyl-2-(4-propan-2-yl-1-piperazin-4-iumyl)-3-pyridin-1-iumsulfonamide IUPAC Name: N-methyl-2-(4-propan-2-ylpiperazin-4-ium-1-yl)pyridin-1-ium-3-sulfonamide Traditional Name: 2-(4-isopropylpiperazin-4-ium-1-yl)-N-methyl-pyridin-1-ium-3-sulfonamide Formula: C13H24N4O2S+2 MolecularWeight: 300.42026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCN(CC1)C2=C(C=CC=[NH+]2)S(=O)(=O)NC

Isomeric SMILES

CC(C)[NH+]1CCN(CC1)C2=C(C=CC=[NH+]2)S(=O)(=O)NC

InChI

InChI=1S/C13H22N4O2S/c1-11(2)16-7-9-17(10-8-16)13-12(5-4-6-15-13)20(18,19)14-3/h4-6,11,14H,7-10H2,1-3H3/p+2