2-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]phthalazin-1-one

Systemtic Name: 2-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]phthalazin-1-one Openeye Name: 2-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]phthalazin-1-one CAS Name: 2-[[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]methyl]-1-phthalazinone IUPAC Name: 2-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methyl]phthalazin-1-one Traditional Name: 2-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]phthalazin-1-one Formula: C24H17ClN4O MolecularWeight: 412.87098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Cl)CN4C(=O)C5=CC=CC=C5C=N4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Cl)CN4C(=O)C5=CC=CC=C5C=N4

InChI

InChI=1S/C24H17ClN4O/c25-20-12-10-17(11-13-20)23-19(15-28(27-23)21-7-2-1-3-8-21)16-29-24(30)22-9-5-4-6-18(22)14-26-29/h1-15H,16H2