4-[(4-bromophenyl)-(1-methyl-5-oxidanylidene-3-phenyl-4H-pyrazol-4-yl)methyl]-2-methyl-5-phenyl-4H-pyrazol-3-one

Systemtic Name: 4-[(4-bromophenyl)-(1-methyl-5-oxidanylidene-3-phenyl-4H-pyrazol-4-yl)methyl]-2-methyl-5-phenyl-4H-pyrazol-3-one Openeye Name: 4-[(4-bromophenyl)-(1-methyl-5-oxo-3-phenyl-4H-pyrazol-4-yl)methyl]-2-methyl-5-phenyl-4H-pyrazol-3-one CAS Name: 4-[(4-bromophenyl)-(1-methyl-5-oxo-3-phenyl-4H-pyrazol-4-yl)methyl]-2-methyl-5-phenyl-4H-pyrazol-3-one IUPAC Name: 4-[(4-bromophenyl)-(1-methyl-5-oxo-3-phenyl-4H-pyrazol-4-yl)methyl]-2-methyl-5-phenyl-4H-pyrazol-3-one Traditional Name: 4-[(4-bromophenyl)-(5-keto-1-methyl-3-phenyl-2-pyrazolin-4-yl)methyl]-2-methyl-5-phenyl-2-pyrazolin-3-one Formula: C27H23BrN4O2 MolecularWeight: 515.40112

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(C(=N1)C2=CC=CC=C2)C(C3C(=NN(C3=O)C)C4=CC=CC=C4)C5=CC=C(C=C5)Br

Isomeric SMILES

CN1C(=O)C(C(=N1)C2=CC=CC=C2)C(C3C(=NN(C3=O)C)C4=CC=CC=C4)C5=CC=C(C=C5)Br

InChI

InChI=1S/C27H23BrN4O2/c1-31-26(33)22(24(29-31)18-9-5-3-6-10-18)21(17-13-15-20(28)16-14-17)23-25(30-32(2)27(23)34)19-11-7-4-8-12-19/h3-16,21-23H,1-2H3