ethyl (2Z)-2-[(5-benzamido-1-methyl-3-phenyl-pyrazol-4-yl)hydrazinylidene]-2-cyano-ethanoate

Systemtic Name: ethyl (2Z)-2-[(5-benzamido-1-methyl-3-phenyl-pyrazol-4-yl)hydrazinylidene]-2-cyano-ethanoate Openeye Name: ethyl (2Z)-2-[(5-benzamido-1-methyl-3-phenyl-pyrazol-4-yl)hydrazono]-2-cyano-acetate CAS Name: (2Z)-2-[(5-benzamido-1-methyl-3-phenyl-4-pyrazolyl)hydrazinylidene]-2-cyanoacetic acid ethyl ester IUPAC Name: ethyl (2Z)-2-[(5-benzamido-1-methyl-3-phenylpyrazol-4-yl)hydrazinylidene]-2-cyanoacetate Traditional Name: (2Z)-2-[(5-benzamido-1-methyl-3-phenyl-pyrazol-4-yl)hydrazono]-2-cyano-acetic acid ethyl ester Formula: C22H20N6O3 MolecularWeight: 416.4326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=NNC1=C(N(N=C1C2=CC=CC=C2)C)NC(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

CCOC(=O)/C(=N\NC1=C(N(N=C1C2=CC=CC=C2)C)NC(=O)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C22H20N6O3/c1-3-31-22(30)17(14-23)25-26-19-18(15-10-6-4-7-11-15)27-28(2)20(19)24-21(29)16-12-8-5-9-13-16/h4-13,26H,3H2,1-2H3,(H,24,29)/b25-17-