1-butyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[methyl-[4-(trifluoromethyl)benzyl]amino]methyl]benzimidazole-5-sulfonamide Formula: C21H25F3N4O2S MolecularWeight: 454.50901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN(C)CC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN(C)CC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H25F3N4O2S/c1-3-4-11-28-19-10-9-17(31(25,29)30)12-18(19)26-20(28)14-27(2)13-15-5-7-16(8-6-15)21(22,23)24/h5-10,12H,3-4,11,13-14H2,1-2H3,(H2,25,29,30)