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

Systemtic Name: 1-butyl-2-[[4-(phenylmethyl)piperazin-1-yl]methyl]benzimidazole-5-sulfonamide Openeye Name: 2-[(4-benzylpiperazin-1-yl)methyl]-1-butyl-benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[4-(phenylmethyl)-1-piperazinyl]methyl]-5-benzimidazolesulfonamide IUPAC Name: 2-[(4-benzylpiperazin-1-yl)methyl]-1-butylbenzimidazole-5-sulfonamide Traditional Name: 2-[(4-benzylpiperazino)methyl]-1-butyl-benzimidazole-5-sulfonamide Formula: C23H31N5O2S MolecularWeight: 441.58954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H31N5O2S/c1-2-3-11-28-22-10-9-20(31(24,29)30)16-21(22)25-23(28)18-27-14-12-26(13-15-27)17-19-7-5-4-6-8-19/h4-10,16H,2-3,11-15,17-18H2,1H3,(H2,24,29,30)