2-[(3,4-dimethoxypyridin-2-yl)methylsulfanyl]-5,6-bis(fluoranyl)-1H-benzimidazole

Systemtic Name: 2-[(3,4-dimethoxypyridin-2-yl)methylsulfanyl]-5,6-bis(fluoranyl)-1H-benzimidazole Openeye Name: 2-[(3,4-dimethoxy-2-pyridyl)methylsulfanyl]-5,6-difluoro-1H-benzimidazole CAS Name: 2-[(3,4-dimethoxy-2-pyridinyl)methylthio]-5,6-difluoro-1H-benzimidazole IUPAC Name: 2-[(3,4-dimethoxypyridin-2-yl)methylsulfanyl]-5,6-difluoro-1H-benzimidazole Traditional Name: 2-[(3,4-dimethoxy-2-pyridyl)methylthio]-5,6-difluoro-1H-benzimidazole Formula: C15H13F2N3O2S MolecularWeight: 337.344426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=NC=C1)CSC2=NC3=CC(=C(C=C3N2)F)F)OC

Isomeric SMILES

COC1=C(C(=NC=C1)CSC2=NC3=CC(=C(C=C3N2)F)F)OC

InChI

InChI=1S/C15H13F2N3O2S/c1-21-13-3-4-18-12(14(13)22-2)7-23-15-19-10-5-8(16)9(17)6-11(10)20-15/h3-6H,7H2,1-2H3,(H,19,20)