N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanamide

Systemtic Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanamide Openeye Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-(3-methyl-4-oxo-phthalazin-1-yl)acetamide CAS Name: N-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methyl]-2-(3-methyl-4-oxo-1-phthalazinyl)acetamide IUPAC Name: N-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methyl]-2-(3-methyl-4-oxophthalazin-1-yl)acetamide Traditional Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-(4-keto-3-methyl-phthalazin-1-yl)acetamide Formula: C27H22FN5O2 MolecularWeight: 467.494283

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)NCC3=CN(N=C3C4=CC=C(C=C4)F)C5=CC=CC=C5

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)NCC3=CN(N=C3C4=CC=C(C=C4)F)C5=CC=CC=C5

InChI

InChI=1S/C27H22FN5O2/c1-32-27(35)23-10-6-5-9-22(23)24(30-32)15-25(34)29-16-19-17-33(21-7-3-2-4-8-21)31-26(19)18-11-13-20(28)14-12-18/h2-14,17H,15-16H2,1H3,(H,29,34)