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

Systemtic Name: 1-butyl-2-[[4-[(4-cyanophenyl)methyl]piperazin-1-yl]methyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[[4-[(4-cyanophenyl)methyl]piperazin-1-yl]methyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[4-[(4-cyanophenyl)methyl]-1-piperazinyl]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[[4-[(4-cyanophenyl)methyl]piperazin-1-yl]methyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[4-(4-cyanobenzyl)piperazino]methyl]benzimidazole-5-sulfonamide Formula: C24H30N6O2S MolecularWeight: 466.599

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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=C(C=C4)C#N

Isomeric SMILES

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

InChI

InChI=1S/C24H30N6O2S/c1-2-3-10-30-23-9-8-21(33(26,31)32)15-22(23)27-24(30)18-29-13-11-28(12-14-29)17-20-6-4-19(16-25)5-7-20/h4-9,15H,2-3,10-14,17-18H2,1H3,(H2,26,31,32)