2-[2-(2-chloranyl-2-methyl-propyl)sulfanyl-4-methoxy-5,6-dimethyl-3-(trifluoromethyl)pyridin-1-ium-1-yl]-1H-benzimidazole

Systemtic Name: 2-[2-(2-chloranyl-2-methyl-propyl)sulfanyl-4-methoxy-5,6-dimethyl-3-(trifluoromethyl)pyridin-1-ium-1-yl]-1H-benzimidazole Openeye Name: 2-[2-(2-chloro-2-methyl-propyl)sulfanyl-4-methoxy-5,6-dimethyl-3-(trifluoromethyl)pyridin-1-ium-1-yl]-1H-benzimidazole CAS Name: 2-[2-[(2-chloro-2-methylpropyl)thio]-4-methoxy-5,6-dimethyl-3-(trifluoromethyl)-1-pyridin-1-iumyl]-1H-benzimidazole IUPAC Name: 2-[2-(2-chloro-2-methylpropyl)sulfanyl-4-methoxy-5,6-dimethyl-3-(trifluoromethyl)pyridin-1-ium-1-yl]-1H-benzimidazole Traditional Name: 2-[2-[(2-chloro-2-methyl-propyl)thio]-4-methoxy-5,6-dimethyl-3-(trifluoromethyl)pyridin-1-ium-1-yl]-1H-benzimidazole Formula: C20H22ClF3N3OS+ MolecularWeight: 444.92139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C([N+](=C1C)C2=NC3=CC=CC=C3N2)SCC(C)(C)Cl)C(F)(F)F)OC

Isomeric SMILES

CC1=C(C(=C([N+](=C1C)C2=NC3=CC=CC=C3N2)SCC(C)(C)Cl)C(F)(F)F)OC

InChI

InChI=1S/C20H22ClF3N3OS/c1-11-12(2)27(18-25-13-8-6-7-9-14(13)26-18)17(29-10-19(3,4)21)15(16(11)28-5)20(22,23)24/h6-9H,10H2,1-5H3,(H,25,26)/q+1