4-[5-(dimethylamino)-3-oxidanylidene-1H-1,2,4-triazol-2-yl]-5-fluoranyl-2-methoxy-benzenecarbonitrile

Systemtic Name: 4-[5-(dimethylamino)-3-oxidanylidene-1H-1,2,4-triazol-2-yl]-5-fluoranyl-2-methoxy-benzenecarbonitrile Openeye Name: 4-[5-(dimethylamino)-3-oxo-1H-1,2,4-triazol-2-yl]-5-fluoro-2-methoxy-benzonitrile CAS Name: 4-[5-(dimethylamino)-3-oxo-1H-1,2,4-triazol-2-yl]-5-fluoro-2-methoxybenzonitrile IUPAC Name: 4-[5-(dimethylamino)-3-oxo-1H-1,2,4-triazol-2-yl]-5-fluoro-2-methoxybenzonitrile Traditional Name: 4-[5-(dimethylamino)-3-keto-1H-1,2,4-triazol-2-yl]-5-fluoro-2-methoxy-benzonitrile Formula: C12H12FN5O2 MolecularWeight: 277.254383

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=O)N(N1)C2=C(C=C(C(=C2)OC)C#N)F

Isomeric SMILES

CN(C)C1=NC(=O)N(N1)C2=C(C=C(C(=C2)OC)C#N)F

InChI

InChI=1S/C12H12FN5O2/c1-17(2)11-15-12(19)18(16-11)9-5-10(20-3)7(6-14)4-8(9)13/h4-5H,1-3H3,(H,15,16,19)