2-[(4-methoxy-5-methyl-pyridin-2-yl)methylsulfanyl]-5,6-bis(trifluoromethyloxy)-1H-benzimidazole

Systemtic Name: 2-[(4-methoxy-5-methyl-pyridin-2-yl)methylsulfanyl]-5,6-bis(trifluoromethyloxy)-1H-benzimidazole Openeye Name: 2-[(4-methoxy-5-methyl-2-pyridyl)methylsulfanyl]-5,6-bis(trifluoromethoxy)-1H-benzimidazole CAS Name: 2-[(4-methoxy-5-methyl-2-pyridinyl)methylthio]-5,6-bis(trifluoromethoxy)-1H-benzimidazole IUPAC Name: 2-[(4-methoxy-5-methylpyridin-2-yl)methylsulfanyl]-5,6-bis(trifluoromethoxy)-1H-benzimidazole Traditional Name: 2-[(4-methoxy-5-methyl-2-pyridyl)methylthio]-5,6-bis(trifluoromethoxy)-1H-benzimidazole Formula: C17H13F6N3O3S MolecularWeight: 453.358839

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1OC)CSC2=NC3=CC(=C(C=C3N2)OC(F)(F)F)OC(F)(F)F

Isomeric SMILES

CC1=CN=C(C=C1OC)CSC2=NC3=CC(=C(C=C3N2)OC(F)(F)F)OC(F)(F)F

InChI

InChI=1S/C17H13F6N3O3S/c1-8-6-24-9(3-12(8)27-2)7-30-15-25-10-4-13(28-16(18,19)20)14(5-11(10)26-15)29-17(21,22)23/h3-6H,7H2,1-2H3,(H,25,26)