2-[methyl-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-1-ium-2-yl]amino]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[methyl-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-1-ium-2-yl]amino]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[methyl-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-1-ium-2-yl]amino]-N-(p-tolyl)acetamide CAS Name: 2-[methyl-[5-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-2-pyridin-1-iumyl]amino]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[methyl-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-1-ium-2-yl]amino]-N-(4-methylphenyl)acetamide Traditional Name: 2-[methyl-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-1-ium-2-yl]amino]-N-(p-tolyl)acetamide Formula: C20H29N5O3S+2 MolecularWeight: 419.54096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C2=[NH+]C=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C2=[NH+]C=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C20H27N5O3S/c1-16-4-6-17(7-5-16)22-20(26)15-24(3)19-9-8-18(14-21-19)29(27,28)25-12-10-23(2)11-13-25/h4-9,14H,10-13,15H2,1-3H3,(H,22,26)/p+2