2-[4-[bis[2-(2-chlorophenyl)-3-oxidanylidene-5-phenyl-1H-pyrazol-4-yl]methyl]-2-bromanyl-6-methoxy-phenoxy]-N-phenyl-ethanamide

Systemtic Name: 2-[4-[bis[2-(2-chlorophenyl)-3-oxidanylidene-5-phenyl-1H-pyrazol-4-yl]methyl]-2-bromanyl-6-methoxy-phenoxy]-N-phenyl-ethanamide Openeye Name: 2-[4-[bis[2-(2-chlorophenyl)-3-oxo-5-phenyl-1H-pyrazol-4-yl]methyl]-2-bromo-6-methoxy-phenoxy]-N-phenyl-acetamide CAS Name: 2-[4-[bis[2-(2-chlorophenyl)-3-oxo-5-phenyl-1H-pyrazol-4-yl]methyl]-2-bromo-6-methoxyphenoxy]-N-phenylacetamide IUPAC Name: 2-[4-[bis[2-(2-chlorophenyl)-3-oxo-5-phenyl-1H-pyrazol-4-yl]methyl]-2-bromo-6-methoxyphenoxy]-N-phenylacetamide Traditional Name: 2-[4-[bis[1-(2-chlorophenyl)-5-keto-3-phenyl-3-pyrazolin-4-yl]methyl]-2-bromo-6-methoxy-phenoxy]-N-phenyl-acetamide Formula: C46H34BrCl2N5O5 MolecularWeight: 887.60266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(C2=C(NN(C2=O)C3=CC=CC=C3Cl)C4=CC=CC=C4)C5=C(NN(C5=O)C6=CC=CC=C6Cl)C7=CC=CC=C7)Br)OCC(=O)NC8=CC=CC=C8

Isomeric SMILES

COC1=C(C(=CC(=C1)C(C2=C(NN(C2=O)C3=CC=CC=C3Cl)C4=CC=CC=C4)C5=C(NN(C5=O)C6=CC=CC=C6Cl)C7=CC=CC=C7)Br)OCC(=O)NC8=CC=CC=C8

InChI

InChI=1S/C46H34BrCl2N5O5/c1-58-37-26-30(25-32(47)44(37)59-27-38(55)50-31-19-9-4-10-20-31)39(40-42(28-15-5-2-6-16-28)51-53(45(40)56)35-23-13-11-21-33(35)48)41-43(29-17-7-3-8-18-29)52-54(46(41)57)36-24-14-12-22-34(36)49/h2-26,39,51-52H,27H2,1H3,(H,50,55)