N-[1-methyl-2-[[4-(2-methylpropanoyl)piperazin-1-yl]methyl]-3H-benzimidazol-1-ium-5-yl]benzenesulfonamide

Systemtic Name: N-[1-methyl-2-[[4-(2-methylpropanoyl)piperazin-1-yl]methyl]-3H-benzimidazol-1-ium-5-yl]benzenesulfonamide Openeye Name: N-[1-methyl-2-[[4-(2-methylpropanoyl)piperazin-1-yl]methyl]-3H-benzimidazol-1-ium-5-yl]benzenesulfonamide CAS Name: N-[1-methyl-2-[[4-(2-methyl-1-oxopropyl)-1-piperazinyl]methyl]-3H-benzimidazol-1-ium-5-yl]benzenesulfonamide IUPAC Name: N-[1-methyl-2-[[4-(2-methylpropanoyl)piperazin-1-yl]methyl]-3H-benzimidazol-1-ium-5-yl]benzenesulfonamide Traditional Name: N-[2-[(4-isobutyrylpiperazino)methyl]-1-methyl-3H-benzimidazol-1-ium-5-yl]benzenesulfonamide Formula: C23H30N5O3S+ MolecularWeight: 456.581

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)CC2=[N+](C3=C(N2)C=C(C=C3)NS(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)CC2=[N+](C3=C(N2)C=C(C=C3)NS(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C23H29N5O3S/c1-17(2)23(29)28-13-11-27(12-14-28)16-22-24-20-15-18(9-10-21(20)26(22)3)25-32(30,31)19-7-5-4-6-8-19/h4-10,15,17,25H,11-14,16H2,1-3H3/p+1