1-butyl-2-[[[1-(4-chlorophenyl)-2-methyl-propyl]amino]methyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[[[1-(4-chlorophenyl)-2-methyl-propyl]amino]methyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[[[1-(4-chlorophenyl)-2-methyl-propyl]amino]methyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[[1-(4-chlorophenyl)-2-methylpropyl]amino]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[[[1-(4-chlorophenyl)-2-methylpropyl]amino]methyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[[1-(4-chlorophenyl)-2-methyl-propyl]amino]methyl]benzimidazole-5-sulfonamide Formula: C22H29ClN4O2S MolecularWeight: 449.00926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CNC(C3=CC=C(C=C3)Cl)C(C)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CNC(C3=CC=C(C=C3)Cl)C(C)C

InChI

InChI=1S/C22H29ClN4O2S/c1-4-5-12-27-20-11-10-18(30(24,28)29)13-19(20)26-21(27)14-25-22(15(2)3)16-6-8-17(23)9-7-16/h6-11,13,15,22,25H,4-5,12,14H2,1-3H3,(H2,24,28,29)