4-fluoranyl-N'-[3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]benzohydrazide

Systemtic Name: 4-fluoranyl-N'-[3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]benzohydrazide Openeye Name: 4-fluoro-N'-[3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]benzohydrazide CAS Name: 4-fluoro-N'-[3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-1-oxopropyl]benzohydrazide IUPAC Name: 4-fluoro-N'-[3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]benzohydrazide Traditional Name: 4-fluoro-N'-[3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]benzohydrazide Formula: C16H15FN6O3 MolecularWeight: 358.327103

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CCC(=O)NNC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CCC(=O)NNC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H15FN6O3/c1-22-14-12(8-19-22)16(26)23(9-18-14)7-6-13(24)20-21-15(25)10-2-4-11(17)5-3-10/h2-5,8-9H,6-7H2,1H3,(H,20,24)(H,21,25)