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

Systemtic Name: 1-(cyclopropylmethyl)-2-(2,2-dimethylpropyl)-5-(trifluoromethylsulfonyl)benzimidazole Openeye Name: 1-(cyclopropylmethyl)-2-(2,2-dimethylpropyl)-5-(trifluoromethylsulfonyl)benzimidazole CAS Name: 1-(cyclopropylmethyl)-2-(2,2-dimethylpropyl)-5-(trifluoromethylsulfonyl)benzimidazole IUPAC Name: 1-(cyclopropylmethyl)-2-(2,2-dimethylpropyl)-5-(trifluoromethylsulfonyl)benzimidazole Traditional Name: 1-(cyclopropylmethyl)-2-neopentyl-5-triflyl-benzimidazole Formula: C17H21F3N2O2S MolecularWeight: 374.42105

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21F3N2O2S/c1-16(2,3)9-15-21-13-8-12(25(23,24)17(18,19)20)6-7-14(13)22(15)10-11-4-5-11/h6-8,11H,4-5,9-10H2,1-3H3