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

Systemtic Name: 4-[(3-bromanyl-5-ethoxy-4-propoxy-phenyl)-(2-methyl-3-oxidanylidene-5-phenyl-1H-pyrazol-4-yl)methyl]-2-methyl-5-phenyl-1H-pyrazol-3-one Openeye Name: 4-[(3-bromo-5-ethoxy-4-propoxy-phenyl)-(2-methyl-3-oxo-5-phenyl-1H-pyrazol-4-yl)methyl]-2-methyl-5-phenyl-1H-pyrazol-3-one CAS Name: 4-[(3-bromo-5-ethoxy-4-propoxyphenyl)-(2-methyl-3-oxo-5-phenyl-1H-pyrazol-4-yl)methyl]-2-methyl-5-phenyl-1H-pyrazol-3-one IUPAC Name: 4-[(3-bromo-5-ethoxy-4-propoxyphenyl)-(2-methyl-3-oxo-5-phenyl-1H-pyrazol-4-yl)methyl]-2-methyl-5-phenyl-1H-pyrazol-3-one Traditional Name: 4-[(3-bromo-5-ethoxy-4-propoxy-phenyl)-(5-keto-1-methyl-3-phenyl-3-pyrazolin-4-yl)methyl]-2-methyl-5-phenyl-3-pyrazolin-3-one Formula: C32H33BrN4O4 MolecularWeight: 617.53282

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C(C2=C(NN(C2=O)C)C3=CC=CC=C3)C4=C(NN(C4=O)C)C5=CC=CC=C5)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C(C2=C(NN(C2=O)C)C3=CC=CC=C3)C4=C(NN(C4=O)C)C5=CC=CC=C5)OCC

InChI

InChI=1S/C32H33BrN4O4/c1-5-17-41-30-23(33)18-22(19-24(30)40-6-2)25(26-28(34-36(3)31(26)38)20-13-9-7-10-14-20)27-29(35-37(4)32(27)39)21-15-11-8-12-16-21/h7-16,18-19,25,34-35H,5-6,17H2,1-4H3