N-(furan-2-ylmethyl)-4-methyl-N-[2-oxidanylidene-2-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]ethyl]benzenesulfonamide

Systemtic Name: N-(furan-2-ylmethyl)-4-methyl-N-[2-oxidanylidene-2-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]ethyl]benzenesulfonamide Openeye Name: N-(2-furylmethyl)-4-methyl-N-[2-oxo-2-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]ethyl]benzenesulfonamide CAS Name: N-(2-furanylmethyl)-4-methyl-N-[2-oxo-2-[4-(pyridin-4-ylmethyl)-1-piperazin-4-iumyl]ethyl]benzenesulfonamide IUPAC Name: N-(furan-2-ylmethyl)-4-methyl-N-[2-oxo-2-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]ethyl]benzenesulfonamide Traditional Name: N-(2-furfuryl)-N-[2-keto-2-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]ethyl]-4-methyl-benzenesulfonamide Formula: C24H29N4O4S+ MolecularWeight: 469.57646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CO2)CC(=O)N3CC[NH+](CC3)CC4=CC=NC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CO2)CC(=O)N3CC[NH+](CC3)CC4=CC=NC=C4

InChI

InChI=1S/C24H28N4O4S/c1-20-4-6-23(7-5-20)33(30,31)28(18-22-3-2-16-32-22)19-24(29)27-14-12-26(13-15-27)17-21-8-10-25-11-9-21/h2-11,16H,12-15,17-19H2,1H3/p+1