4-(3-tert-butyl-5-oxidanylidene-4-prop-2-ynyl-1,2,4-triazol-1-yl)-5-fluoranyl-2-prop-2-enoxy-benzenecarbonitrile

Systemtic Name: 4-(3-tert-butyl-5-oxidanylidene-4-prop-2-ynyl-1,2,4-triazol-1-yl)-5-fluoranyl-2-prop-2-enoxy-benzenecarbonitrile Openeye Name: 2-allyloxy-4-(3-tert-butyl-5-oxo-4-prop-2-ynyl-1,2,4-triazol-1-yl)-5-fluoro-benzonitrile CAS Name: 4-(3-tert-butyl-5-oxo-4-prop-2-ynyl-1,2,4-triazol-1-yl)-5-fluoro-2-prop-2-enoxybenzonitrile IUPAC Name: 4-(3-tert-butyl-5-oxo-4-prop-2-ynyl-1,2,4-triazol-1-yl)-5-fluoro-2-prop-2-enoxybenzonitrile Traditional Name: 2-allyloxy-4-(3-tert-butyl-5-keto-4-propargyl-1,2,4-triazol-1-yl)-5-fluoro-benzonitrile Formula: C19H19FN4O2 MolecularWeight: 354.378163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=O)N1CC#C)C2=C(C=C(C(=C2)OCC=C)C#N)F

Isomeric SMILES

CC(C)(C)C1=NN(C(=O)N1CC#C)C2=C(C=C(C(=C2)OCC=C)C#N)F

InChI

InChI=1S/C19H19FN4O2/c1-6-8-23-17(19(3,4)5)22-24(18(23)25)15-11-16(26-9-7-2)13(12-21)10-14(15)20/h1,7,10-11H,2,8-9H2,3-5H3