N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-3-morpholinosulfonyl-benzamide CAS Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-3-morpholinosulfonyl-benzamide Formula: C22H23N6O4S+ MolecularWeight: 467.52082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](N1)C2=NC3=CC=CC=C3N2)NC(=O)C4=CC(=CC=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CC1=CC(=[N+](N1)C2=NC3=CC=CC=C3N2)NC(=O)C4=CC(=CC=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C22H22N6O4S/c1-15-13-20(28(26-15)22-23-18-7-2-3-8-19(18)24-22)25-21(29)16-5-4-6-17(14-16)33(30,31)27-9-11-32-12-10-27/h2-8,13-14H,9-12H2,1H3,(H2,23,24,25,26,29)/p+1