1-butyl-2-[[[(4-fluorophenyl)-thiophen-2-yl-methyl]amino]methyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[[[(4-fluorophenyl)-thiophen-2-yl-methyl]amino]methyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[[[(4-fluorophenyl)-(2-thienyl)methyl]amino]methyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[[(4-fluorophenyl)-thiophen-2-ylmethyl]amino]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[[[(4-fluorophenyl)-thiophen-2-ylmethyl]amino]methyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[[(4-fluorophenyl)-(2-thienyl)methyl]amino]methyl]benzimidazole-5-sulfonamide Formula: C23H25FN4O2S2 MolecularWeight: 472.598603

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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)F)C4=CC=CS4

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CNC(C3=CC=C(C=C3)F)C4=CC=CS4

InChI

InChI=1S/C23H25FN4O2S2/c1-2-3-12-28-20-11-10-18(32(25,29)30)14-19(20)27-22(28)15-26-23(21-5-4-13-31-21)16-6-8-17(24)9-7-16/h4-11,13-14,23,26H,2-3,12,15H2,1H3,(H2,25,29,30)