4-[bis(fluoranyl)methyl]-2-(3-methoxy-4-methyl-phenyl)-5-methyl-1,2,4-triazol-3-one

Systemtic Name: 4-[bis(fluoranyl)methyl]-2-(3-methoxy-4-methyl-phenyl)-5-methyl-1,2,4-triazol-3-one Openeye Name: 4-(difluoromethyl)-2-(3-methoxy-4-methyl-phenyl)-5-methyl-1,2,4-triazol-3-one CAS Name: 4-(difluoromethyl)-2-(3-methoxy-4-methylphenyl)-5-methyl-1,2,4-triazol-3-one IUPAC Name: 4-(difluoromethyl)-2-(3-methoxy-4-methylphenyl)-5-methyl-1,2,4-triazol-3-one Traditional Name: 4-(difluoromethyl)-2-(3-methoxy-4-methyl-phenyl)-5-methyl-1,2,4-triazol-3-one Formula: C12H13F2N3O2 MolecularWeight: 269.247326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)N(C(=N2)C)C(F)F)OC

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)N(C(=N2)C)C(F)F)OC

InChI

InChI=1S/C12H13F2N3O2/c1-7-4-5-9(6-10(7)19-3)17-12(18)16(11(13)14)8(2)15-17/h4-6,11H,1-3H3