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

Systemtic Name: 4-[(4-bromophenyl)-(3-oxidanylidene-5-phenyl-1,2-dihydropyrazol-4-yl)methyl]-5-phenyl-1,2-dihydropyrazol-3-one Openeye Name: 4-[(4-bromophenyl)-(3-oxo-5-phenyl-1,2-dihydropyrazol-4-yl)methyl]-5-phenyl-1,2-dihydropyrazol-3-one CAS Name: 4-[(4-bromophenyl)-(3-oxo-5-phenyl-1,2-dihydropyrazol-4-yl)methyl]-5-phenyl-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(4-bromophenyl)-(3-oxo-5-phenyl-1,2-dihydropyrazol-4-yl)methyl]-5-phenyl-1,2-dihydropyrazol-3-one Traditional Name: 4-[(4-bromophenyl)-(3-keto-5-phenyl-3-pyrazolin-4-yl)methyl]-5-phenyl-3-pyrazolin-3-one Formula: C25H19BrN4O2 MolecularWeight: 487.34796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)NN2)C(C3=CC=C(C=C3)Br)C4=C(NNC4=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)NN2)C(C3=CC=C(C=C3)Br)C4=C(NNC4=O)C5=CC=CC=C5

InChI

InChI=1S/C25H19BrN4O2/c26-18-13-11-15(12-14-18)19(20-22(27-29-24(20)31)16-7-3-1-4-8-16)21-23(28-30-25(21)32)17-9-5-2-6-10-17/h1-14,19H,(H2,27,29,31)(H2,28,30,32)