1-butyl-2-[[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]methyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]methyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]methyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[[4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl]methyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[4-(2-chloro-6-fluoro-benzyl)piperazino]methyl]benzimidazole-5-sulfonamide Formula: C23H29ClFN5O2S MolecularWeight: 494.025063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN3CCN(CC3)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN3CCN(CC3)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C23H29ClFN5O2S/c1-2-3-9-30-22-8-7-17(33(26,31)32)14-21(22)27-23(30)16-29-12-10-28(11-13-29)15-18-19(24)5-4-6-20(18)25/h4-8,14H,2-3,9-13,15-16H2,1H3,(H2,26,31,32)