2-methoxy-N-methyl-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbonyl-N-(2-pyridin-3-ylethyl)benzenesulfonamide

Systemtic Name: 2-methoxy-N-methyl-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbonyl-N-(2-pyridin-3-ylethyl)benzenesulfonamide Openeye Name: 2-methoxy-N-methyl-5-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)-N-[2-(3-pyridyl)ethyl]benzenesulfonamide CAS Name: 2-methoxy-N-methyl-5-[oxo-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]-N-[2-(3-pyridinyl)ethyl]benzenesulfonamide IUPAC Name: 2-methoxy-N-methyl-5-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)-N-(2-pyridin-3-ylethyl)benzenesulfonamide Traditional Name: 2-methoxy-N-methyl-5-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)-N-[2-(3-pyridyl)ethyl]benzenesulfonamide Formula: C25H30N5O4S+ MolecularWeight: 496.6018

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CN=CC=C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4)OC

Isomeric SMILES

CN(CCC1=CN=CC=C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4)OC

InChI

InChI=1S/C25H29N5O4S/c1-28(13-10-20-6-5-11-26-19-20)35(32,33)23-18-21(8-9-22(23)34-2)25(31)30-16-14-29(15-17-30)24-7-3-4-12-27-24/h3-9,11-12,18-19H,10,13-17H2,1-2H3/p+1