4-acetamido-N-[(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)methylideneamino]benzamide

Systemtic Name: 4-acetamido-N-[(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)methylideneamino]benzamide Openeye Name: 4-acetamido-N-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)methyleneamino]benzamide CAS Name: 4-acetamido-N-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)methylideneamino]benzamide IUPAC Name: 4-acetamido-N-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)methylideneamino]benzamide Traditional Name: 4-acetamido-N-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl)methyleneamino]benzamide Formula: C20H19N5O3 MolecularWeight: 377.39656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1C=NNC(=O)C2=CC=C(C=C2)NC(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=O)C1C=NNC(=O)C2=CC=C(C=C2)NC(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C20H19N5O3/c1-13-18(20(28)25(24-13)17-6-4-3-5-7-17)12-21-23-19(27)15-8-10-16(11-9-15)22-14(2)26/h3-12,18H,1-2H3,(H,22,26)(H,23,27)