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

Systemtic Name: (4E)-4-[[(2,5-dimethylphenyl)amino]methylidene]-5-methyl-2-(4-methylphenyl)pyrazol-3-one Openeye Name: (4E)-4-[(2,5-dimethylanilino)methylene]-5-methyl-2-(p-tolyl)pyrazol-3-one CAS Name: (4E)-4-[(2,5-dimethylanilino)methylidene]-5-methyl-2-(4-methylphenyl)-3-pyrazolone IUPAC Name: (4E)-4-[(2,5-dimethylanilino)methylidene]-5-methyl-2-(4-methylphenyl)pyrazol-3-one Traditional Name: (4E)-4-[(2,5-dimethylanilino)methylene]-5-methyl-2-(p-tolyl)-2-pyrazolin-3-one Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O/c1-13-6-9-17(10-7-13)23-20(24)18(16(4)22-23)12-21-19-11-14(2)5-8-15(19)3/h5-12,21H,1-4H3/b18-12+