3-(4-chloranyl-2-fluoranyl-5-prop-2-ynoxy-phenyl)-5,7-dimethyl-pyrazolo[3,4-d][1,2,3]triazin-4-one

Systemtic Name: 3-(4-chloranyl-2-fluoranyl-5-prop-2-ynoxy-phenyl)-5,7-dimethyl-pyrazolo[3,4-d][1,2,3]triazin-4-one Openeye Name: 3-(4-chloro-2-fluoro-5-prop-2-ynoxy-phenyl)-5,7-dimethyl-pyrazolo[3,4-d]triazin-4-one CAS Name: 3-(4-chloro-2-fluoro-5-prop-2-ynoxyphenyl)-5,7-dimethyl-4-pyrazolo[3,4-d]triazinone IUPAC Name: 3-(4-chloro-2-fluoro-5-prop-2-ynoxyphenyl)-5,7-dimethylpyrazolo[3,4-d]triazin-4-one Traditional Name: 3-(4-chloro-2-fluoro-5-propargyloxy-phenyl)-5,7-dimethyl-pyrazolo[3,4-d]triazin-4-one Formula: C15H11ClFN5O2 MolecularWeight: 347.731543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=O)N(N=N2)C3=CC(=C(C=C3F)Cl)OCC#C)C

Isomeric SMILES

CC1=NN(C2=C1C(=O)N(N=N2)C3=CC(=C(C=C3F)Cl)OCC#C)C

InChI

InChI=1S/C15H11ClFN5O2/c1-4-5-24-12-7-11(10(17)6-9(12)16)22-15(23)13-8(2)19-21(3)14(13)18-20-22/h1,6-7H,5H2,2-3H3