4-[(2,5-dimethyl-1-pyridin-3-yl-pyrrol-3-yl)methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[(2,5-dimethyl-1-pyridin-3-yl-pyrrol-3-yl)methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[2,5-dimethyl-1-(3-pyridyl)pyrrol-3-yl]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[2,5-dimethyl-1-(3-pyridinyl)-3-pyrrolyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[(2,5-dimethyl-1-pyridin-3-ylpyrrol-3-yl)methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: 4-[[2,5-dimethyl-1-(3-pyridyl)pyrrol-3-yl]methylene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C22H20N4O MolecularWeight: 356.4204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CN=CC=C2)C)C=C3C(=NN(C3=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(N1C2=CN=CC=C2)C)C=C3C(=NN(C3=O)C4=CC=CC=C4)C

InChI

InChI=1S/C22H20N4O/c1-15-12-18(17(3)25(15)20-10-7-11-23-14-20)13-21-16(2)24-26(22(21)27)19-8-5-4-6-9-19/h4-14H,1-3H3