6,6,8,8-tetrakis(fluoranyl)-2-[(4-methoxypyridin-2-yl)methylsulfanyl]-1H-[1,3]dioxino[4,5-f]benzimidazole

Systemtic Name: 6,6,8,8-tetrakis(fluoranyl)-2-[(4-methoxypyridin-2-yl)methylsulfanyl]-1H-[1,3]dioxino[4,5-f]benzimidazole Openeye Name: 6,6,8,8-tetrafluoro-2-[(4-methoxy-2-pyridyl)methylsulfanyl]-1H-[1,3]dioxino[4,5-f]benzimidazole CAS Name: 6,6,8,8-tetrafluoro-2-[(4-methoxy-2-pyridinyl)methylthio]-1H-[1,3]dioxino[4,5-f]benzimidazole IUPAC Name: 6,6,8,8-tetrafluoro-2-[(4-methoxypyridin-2-yl)methylsulfanyl]-1H-[1,3]dioxino[4,5-f]benzimidazole Traditional Name: 6,6,8,8-tetrafluoro-2-[(4-methoxy-2-pyridyl)methylthio]-1H-[1,3]dioxino[4,5-f]benzimidazole Formula: C16H11F4N3O3S MolecularWeight: 401.335453

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC=C1)CSC2=NC3=C(N2)C=C4C(=C3)OC(OC4(F)F)(F)F

Isomeric SMILES

COC1=CC(=NC=C1)CSC2=NC3=C(N2)C=C4C(=C3)OC(OC4(F)F)(F)F

InChI

InChI=1S/C16H11F4N3O3S/c1-24-9-2-3-21-8(4-9)7-27-14-22-11-5-10-13(6-12(11)23-14)25-16(19,20)26-15(10,17)18/h2-6H,7H2,1H3,(H,22,23)