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

Systemtic Name: (4E)-2-(3,4-dimethylphenyl)-5-methyl-4-[(pyridin-2-ylamino)methylidene]pyrazol-3-one Openeye Name: (4E)-2-(3,4-dimethylphenyl)-5-methyl-4-[(2-pyridylamino)methylene]pyrazol-3-one CAS Name: (4E)-2-(3,4-dimethylphenyl)-5-methyl-4-[(2-pyridinylamino)methylidene]-3-pyrazolone IUPAC Name: (4E)-2-(3,4-dimethylphenyl)-5-methyl-4-[(pyridin-2-ylamino)methylidene]pyrazol-3-one Traditional Name: (4E)-2-(3,4-dimethylphenyl)-5-methyl-4-[(2-pyridylamino)methylene]-2-pyrazolin-3-one Formula: C18H18N4O MolecularWeight: 306.36172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=CNC3=CC=CC=N3)C(=N2)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)/C(=C/NC3=CC=CC=N3)/C(=N2)C)C

InChI

InChI=1S/C18H18N4O/c1-12-7-8-15(10-13(12)2)22-18(23)16(14(3)21-22)11-20-17-6-4-5-9-19-17/h4-11H,1-3H3,(H,19,20)/b16-11+