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

Systemtic Name: 4-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-3-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2,2-difluoro-1,3-benzodioxol-5-yl)-3-methyl-1H-1,2,4-triazole-5-thione CAS Name: 4-(2,2-difluoro-1,3-benzodioxol-5-yl)-3-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2,2-difluoro-1,3-benzodioxol-5-yl)-3-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2,2-difluoro-1,3-benzodioxol-5-yl)-3-methyl-1H-1,2,4-triazole-5-thione Formula: C10H7F2N3O2S MolecularWeight: 271.243286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1C2=CC3=C(C=C2)OC(O3)(F)F

Isomeric SMILES

CC1=NNC(=S)N1C2=CC3=C(C=C2)OC(O3)(F)F

InChI

InChI=1S/C10H7F2N3O2S/c1-5-13-14-9(18)15(5)6-2-3-7-8(4-6)17-10(11,12)16-7/h2-4H,1H3,(H,14,18)