N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C25H18FN5O2 MolecularWeight: 439.441123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)F)CNC(=O)C4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)F)CNC(=O)C4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C25H18FN5O2/c26-18-12-10-16(11-13-18)22-17(15-31(30-22)19-6-2-1-3-7-19)14-27-25(33)23-20-8-4-5-9-21(20)24(32)29-28-23/h1-13,15H,14H2,(H,27,33)(H,29,32)