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

Systemtic Name: 4-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-3-propan-2-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2,2-difluoro-1,3-benzodioxol-5-yl)-3-isopropyl-1H-1,2,4-triazole-5-thione CAS Name: 4-(2,2-difluoro-1,3-benzodioxol-5-yl)-3-propan-2-yl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2,2-difluoro-1,3-benzodioxol-5-yl)-3-propan-2-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2,2-difluoro-1,3-benzodioxol-5-yl)-3-isopropyl-1H-1,2,4-triazole-5-thione Formula: C12H11F2N3O2S MolecularWeight: 299.296446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NNC(=S)N1C2=CC3=C(C=C2)OC(O3)(F)F

Isomeric SMILES

CC(C)C1=NNC(=S)N1C2=CC3=C(C=C2)OC(O3)(F)F

InChI

InChI=1S/C12H11F2N3O2S/c1-6(2)10-15-16-11(20)17(10)7-3-4-8-9(5-7)19-12(13,14)18-8/h3-6H,1-2H3,(H,16,20)