1-butyl-2-[[cyclopropyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[[cyclopropyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[[cyclopropyl-[(4-isopropylphenyl)methyl]amino]methyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[cyclopropyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[[cyclopropyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[cyclopropyl-(4-isopropylbenzyl)amino]methyl]benzimidazole-5-sulfonamide Formula: C25H34N4O2S MolecularWeight: 454.62806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN(CC3=CC=C(C=C3)C(C)C)C4CC4

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN(CC3=CC=C(C=C3)C(C)C)C4CC4

InChI

InChI=1S/C25H34N4O2S/c1-4-5-14-29-24-13-12-22(32(26,30)31)15-23(24)27-25(29)17-28(21-10-11-21)16-19-6-8-20(9-7-19)18(2)3/h6-9,12-13,15,18,21H,4-5,10-11,14,16-17H2,1-3H3,(H2,26,30,31)