1-butyl-2-[[4-(2-phenoxyethyl)piperazin-1-yl]methyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[[4-(2-phenoxyethyl)piperazin-1-yl]methyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[[4-(2-phenoxyethyl)piperazin-1-yl]methyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[4-(2-phenoxyethyl)-1-piperazinyl]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[[4-(2-phenoxyethyl)piperazin-1-yl]methyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[4-(2-phenoxyethyl)piperazino]methyl]benzimidazole-5-sulfonamide Formula: C24H33N5O3S MolecularWeight: 471.61552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN3CCN(CC3)CCOC4=CC=CC=C4

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN3CCN(CC3)CCOC4=CC=CC=C4

InChI

InChI=1S/C24H33N5O3S/c1-2-3-11-29-23-10-9-21(33(25,30)31)18-22(23)26-24(29)19-28-14-12-27(13-15-28)16-17-32-20-7-5-4-6-8-20/h4-10,18H,2-3,11-17,19H2,1H3,(H2,25,30,31)