2-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-methyl-imidazole

Systemtic Name: 2-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-methyl-imidazole Openeye Name: 2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-methyl-imidazole CAS Name: 2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-1-methylimidazole IUPAC Name: 2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-methylimidazole Traditional Name: 2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-1-methyl-imidazole Formula: C13H13FN2O2S MolecularWeight: 280.317923

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC2=C3C(=CC(=C2)F)COCO3

Isomeric SMILES

CN1C=CN=C1SCC2=C3C(=CC(=C2)F)COCO3

InChI

InChI=1S/C13H13FN2O2S/c1-16-3-2-15-13(16)19-7-10-5-11(14)4-9-6-17-8-18-12(9)10/h2-5H,6-8H2,1H3