5-cyclopropyl-3-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-cyclopropyl-3-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-cyclopropyl-3-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-cyclopropyl-3-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-cyclopropyl-3-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-cyclopropyl-3-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-1H-1,2,4-triazole Formula: C14H14FN3O2S MolecularWeight: 307.343263

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=NN2)SCC3=C4C(=CC(=C3)F)COCO4

Isomeric SMILES

C1CC1C2=NC(=NN2)SCC3=C4C(=CC(=C3)F)COCO4

InChI

InChI=1S/C14H14FN3O2S/c15-11-3-9-5-19-7-20-12(9)10(4-11)6-21-14-16-13(17-18-14)8-1-2-8/h3-4,8H,1-2,5-7H2,(H,16,17,18)