2-[[4-(3-methoxypropoxy)-3-methyl-pyridin-2-yl]methylsulfanyl]-6-(trifluoromethyl)-1H-benzimidazole

Systemtic Name: 2-[[4-(3-methoxypropoxy)-3-methyl-pyridin-2-yl]methylsulfanyl]-6-(trifluoromethyl)-1H-benzimidazole Openeye Name: 2-[[4-(3-methoxypropoxy)-3-methyl-2-pyridyl]methylsulfanyl]-6-(trifluoromethyl)-1H-benzimidazole CAS Name: 2-[[4-(3-methoxypropoxy)-3-methyl-2-pyridinyl]methylthio]-6-(trifluoromethyl)-1H-benzimidazole IUPAC Name: 2-[[4-(3-methoxypropoxy)-3-methylpyridin-2-yl]methylsulfanyl]-6-(trifluoromethyl)-1H-benzimidazole Traditional Name: 2-[[4-(3-methoxypropoxy)-3-methyl-2-pyridyl]methylthio]-6-(trifluoromethyl)-1H-benzimidazole Formula: C19H20F3N3O2S MolecularWeight: 411.44121

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CSC2=NC3=C(N2)C=C(C=C3)C(F)(F)F)OCCCOC

Isomeric SMILES

CC1=C(C=CN=C1CSC2=NC3=C(N2)C=C(C=C3)C(F)(F)F)OCCCOC

InChI

InChI=1S/C19H20F3N3O2S/c1-12-16(23-7-6-17(12)27-9-3-8-26-2)11-28-18-24-14-5-4-13(19(20,21)22)10-15(14)25-18/h4-7,10H,3,8-9,11H2,1-2H3,(H,24,25)