2-[(4-methoxypyridin-2-yl)methylsulfanyl]-6-(trifluoromethyl)-1H-benzimidazole dihydrochloride

Systemtic Name: 2-[(4-methoxypyridin-2-yl)methylsulfanyl]-6-(trifluoromethyl)-1H-benzimidazole dihydrochloride Openeye Name: 2-[(4-methoxy-2-pyridyl)methylsulfanyl]-6-(trifluoromethyl)-1H-benzimidazole dihydrochloride CAS Name: 2-[(4-methoxy-2-pyridinyl)methylthio]-6-(trifluoromethyl)-1H-benzimidazole dihydrochloride IUPAC Name: 2-[(4-methoxypyridin-2-yl)methylsulfanyl]-6-(trifluoromethyl)-1H-benzimidazole dihydrochloride Traditional Name: 2-[(4-methoxy-2-pyridyl)methylthio]-6-(trifluoromethyl)-1H-benzimidazole dihydrochloride Formula: C15H14Cl2F3N3OS MolecularWeight: 412.25737

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC=C1)CSC2=NC3=C(N2)C=C(C=C3)C(F)(F)F.Cl.Cl

Isomeric SMILES

COC1=CC(=NC=C1)CSC2=NC3=C(N2)C=C(C=C3)C(F)(F)F.Cl.Cl

InChI

InChI=1S/C15H12F3N3OS.2ClH/c1-22-11-4-5-19-10(7-11)8-23-14-20-12-3-2-9(15(16,17)18)6-13(12)21-14;;/h2-7H,8H2,1H3,(H,20,21);2*1H