4-[[2-tert-butyl-1-(cyclohexylmethyl)benzimidazol-5-yl]sulfonylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[2-tert-butyl-1-(cyclohexylmethyl)benzimidazol-5-yl]sulfonylmethyl]benzenecarbonitrile Openeye Name: 4-[[2-tert-butyl-1-(cyclohexylmethyl)benzimidazol-5-yl]sulfonylmethyl]benzonitrile CAS Name: 4-[[2-tert-butyl-1-(cyclohexylmethyl)-5-benzimidazolyl]sulfonylmethyl]benzonitrile IUPAC Name: 4-[[2-tert-butyl-1-(cyclohexylmethyl)benzimidazol-5-yl]sulfonylmethyl]benzonitrile Traditional Name: 4-[[2-tert-butyl-1-(cyclohexylmethyl)benzimidazol-5-yl]sulfonylmethyl]benzonitrile Formula: C26H31N3O2S MolecularWeight: 449.60824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(N1CC3CCCCC3)C=CC(=C2)S(=O)(=O)CC4=CC=C(C=C4)C#N

Isomeric SMILES

CC(C)(C)C1=NC2=C(N1CC3CCCCC3)C=CC(=C2)S(=O)(=O)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C26H31N3O2S/c1-26(2,3)25-28-23-15-22(32(30,31)18-21-11-9-19(16-27)10-12-21)13-14-24(23)29(25)17-20-7-5-4-6-8-20/h9-15,20H,4-8,17-18H2,1-3H3