4-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-3-cyclopropyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-3-cyclopropyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-cyclopropyl-4-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-1,2,4-triazole-5-thione CAS Name: 3-cyclopropyl-4-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-cyclopropyl-4-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-cyclopropyl-4-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-1,2,4-triazole-5-thione Formula: C12H9F2N3O2S MolecularWeight: 297.280566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NNC(=S)N2C3=CC4=C(C=C3)OC(O4)(F)F

Isomeric SMILES

C1CC1C2=NNC(=S)N2C3=CC4=C(C=C3)OC(O4)(F)F

InChI

InChI=1S/C12H9F2N3O2S/c13-12(14)18-8-4-3-7(5-9(8)19-12)17-10(6-1-2-6)15-16-11(17)20/h3-6H,1-2H2,(H,16,20)