1-(cyclopropylmethyl)-2-(2,2-dimethylpropyl)-5-(phenylsulfonyl)benzimidazole

Systemtic Name: 1-(cyclopropylmethyl)-2-(2,2-dimethylpropyl)-5-(phenylsulfonyl)benzimidazole Openeye Name: 5-(benzenesulfonyl)-1-(cyclopropylmethyl)-2-(2,2-dimethylpropyl)benzimidazole CAS Name: 5-(benzenesulfonyl)-1-(cyclopropylmethyl)-2-(2,2-dimethylpropyl)benzimidazole IUPAC Name: 5-(benzenesulfonyl)-1-(cyclopropylmethyl)-2-(2,2-dimethylpropyl)benzimidazole Traditional Name: 5-besyl-1-(cyclopropylmethyl)-2-neopentyl-benzimidazole Formula: C22H26N2O2S MolecularWeight: 382.51904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=NC2=C(N1CC3CC3)C=CC(=C2)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)CC1=NC2=C(N1CC3CC3)C=CC(=C2)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H26N2O2S/c1-22(2,3)14-21-23-19-13-18(27(25,26)17-7-5-4-6-8-17)11-12-20(19)24(21)15-16-9-10-16/h4-8,11-13,16H,9-10,14-15H2,1-3H3