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

Systemtic Name: 4-[[5-(4-bromophenyl)furan-2-yl]-(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one Openeye Name: 4-[[5-(4-bromophenyl)-2-furyl]-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one CAS Name: 4-[[5-(4-bromophenyl)-2-furanyl]-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one IUPAC Name: 4-[[5-(4-bromophenyl)furan-2-yl]-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one Traditional Name: 4-[[5-(4-bromophenyl)-2-furyl]-(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)methyl]-5-methyl-2-phenyl-3-pyrazolin-3-one Formula: C31H25BrN4O3 MolecularWeight: 581.4592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C(C3=CC=C(O3)C4=CC=C(C=C4)Br)C5=C(NN(C5=O)C6=CC=CC=C6)C

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C(C3=CC=C(O3)C4=CC=C(C=C4)Br)C5=C(NN(C5=O)C6=CC=CC=C6)C

InChI

InChI=1S/C31H25BrN4O3/c1-19-27(30(37)35(33-19)23-9-5-3-6-10-23)29(26-18-17-25(39-26)21-13-15-22(32)16-14-21)28-20(2)34-36(31(28)38)24-11-7-4-8-12-24/h3-18,29,33-34H,1-2H3