4-[[(3-bromophenyl)amino]methylidene]-2-(3,4-dimethylphenyl)-5-methyl-pyrazol-3-one

Systemtic Name: 4-[[(3-bromophenyl)amino]methylidene]-2-(3,4-dimethylphenyl)-5-methyl-pyrazol-3-one Openeye Name: 4-[(3-bromoanilino)methylene]-2-(3,4-dimethylphenyl)-5-methyl-pyrazol-3-one CAS Name: 4-[(3-bromoanilino)methylidene]-2-(3,4-dimethylphenyl)-5-methyl-3-pyrazolone IUPAC Name: 4-[(3-bromoanilino)methylidene]-2-(3,4-dimethylphenyl)-5-methylpyrazol-3-one Traditional Name: 4-[(3-bromoanilino)methylene]-2-(3,4-dimethylphenyl)-5-methyl-2-pyrazolin-3-one Formula: C19H18BrN3O MolecularWeight: 384.26972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18BrN3O/c1-12-7-8-17(9-13(12)2)23-19(24)18(14(3)22-23)11-21-16-6-4-5-15(20)10-16/h4-11,21H,1-3H3