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

Systemtic Name: 3-[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]-4-cyclopropyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-cyclopropyl-3-[4-(difluoromethoxy)-3-methoxy-phenyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-cyclopropyl-3-[4-(difluoromethoxy)-3-methoxyphenyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-cyclopropyl-3-[4-(difluoromethoxy)-3-methoxyphenyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-cyclopropyl-3-[4-(difluoromethoxy)-3-methoxy-phenyl]-1H-1,2,4-triazole-5-thione Formula: C13H13F2N3O2S MolecularWeight: 313.323026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=NNC(=S)N2C3CC3)OC(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)C2=NNC(=S)N2C3CC3)OC(F)F

InChI

InChI=1S/C13H13F2N3O2S/c1-19-10-6-7(2-5-9(10)20-12(14)15)11-16-17-13(21)18(11)8-3-4-8/h2,5-6,8,12H,3-4H2,1H3,(H,17,21)