(4E)-4-[[(4-bromanyl-2,3-dimethyl-phenyl)amino]methylidene]-2-(4-bromanyl-3-methyl-phenyl)-5-methyl-pyrazol-3-one

Systemtic Name: (4E)-4-[[(4-bromanyl-2,3-dimethyl-phenyl)amino]methylidene]-2-(4-bromanyl-3-methyl-phenyl)-5-methyl-pyrazol-3-one Openeye Name: (4E)-4-[(4-bromo-2,3-dimethyl-anilino)methylene]-2-(4-bromo-3-methyl-phenyl)-5-methyl-pyrazol-3-one CAS Name: (4E)-4-[(4-bromo-2,3-dimethylanilino)methylidene]-2-(4-bromo-3-methylphenyl)-5-methyl-3-pyrazolone IUPAC Name: (4E)-4-[(4-bromo-2,3-dimethylanilino)methylidene]-2-(4-bromo-3-methylphenyl)-5-methylpyrazol-3-one Traditional Name: (4E)-4-[(4-bromo-2,3-dimethyl-anilino)methylene]-2-(4-bromo-3-methyl-phenyl)-5-methyl-2-pyrazolin-3-one Formula: C20H19Br2N3O MolecularWeight: 477.19236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2C(=O)C(=CNC3=C(C(=C(C=C3)Br)C)C)C(=N2)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N2C(=O)/C(=C/NC3=C(C(=C(C=C3)Br)C)C)/C(=N2)C)Br

InChI

InChI=1S/C20H19Br2N3O/c1-11-9-15(5-6-17(11)21)25-20(26)16(14(4)24-25)10-23-19-8-7-18(22)12(2)13(19)3/h5-10,23H,1-4H3/b16-10+