1-[[3-(2-methylpropoxy)pyridin-2-yl]methylsulfanyl]-5-(trifluoromethyl)benzimidazole

Systemtic Name: 1-[[3-(2-methylpropoxy)pyridin-2-yl]methylsulfanyl]-5-(trifluoromethyl)benzimidazole Openeye Name: 1-[(3-isobutoxy-2-pyridyl)methylsulfanyl]-5-(trifluoromethyl)benzimidazole CAS Name: 1-[[3-(2-methylpropoxy)-2-pyridinyl]methylthio]-5-(trifluoromethyl)benzimidazole IUPAC Name: 1-[[3-(2-methylpropoxy)pyridin-2-yl]methylsulfanyl]-5-(trifluoromethyl)benzimidazole Traditional Name: 1-[(3-isobutoxy-2-pyridyl)methylthio]-5-(trifluoromethyl)benzimidazole Formula: C18H18F3N3OS MolecularWeight: 381.41523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(N=CC=C1)CSN2C=NC3=C2C=CC(=C3)C(F)(F)F

Isomeric SMILES

CC(C)COC1=C(N=CC=C1)CSN2C=NC3=C2C=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H18F3N3OS/c1-12(2)9-25-17-4-3-7-22-15(17)10-26-24-11-23-14-8-13(18(19,20)21)5-6-16(14)24/h3-8,11-12H,9-10H2,1-2H3