N-(4-acetamido-5-oxidanylidene-1-phenyl-4-phenylazanyl-pyrazol-3-yl)-4-methyl-benzamide

Systemtic Name: N-(4-acetamido-5-oxidanylidene-1-phenyl-4-phenylazanyl-pyrazol-3-yl)-4-methyl-benzamide Openeye Name: N-(4-acetamido-4-anilino-5-oxo-1-phenyl-pyrazol-3-yl)-4-methyl-benzamide CAS Name: N-(4-acetamido-4-anilino-5-oxo-1-phenyl-3-pyrazolyl)-4-methylbenzamide IUPAC Name: N-(4-acetamido-4-anilino-5-oxo-1-phenylpyrazol-3-yl)-4-methylbenzamide Traditional Name: N-(4-acetamido-4-anilino-5-keto-1-phenyl-2-pyrazolin-3-yl)-4-methyl-benzamide Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=NN(C(=O)C2(NC3=CC=CC=C3)NC(=O)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=NN(C(=O)C2(NC3=CC=CC=C3)NC(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C25H23N5O3/c1-17-13-15-19(16-14-17)22(32)26-23-25(27-18(2)31,28-20-9-5-3-6-10-20)24(33)30(29-23)21-11-7-4-8-12-21/h3-16,28H,1-2H3,(H,27,31)(H,26,29,32)