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

Systemtic Name: N-(4-acetamido-5-oxidanylidene-1-phenyl-4-phenylazanyl-pyrazol-3-yl)-3,4,5-trimethyl-benzamide Openeye Name: N-(4-acetamido-4-anilino-5-oxo-1-phenyl-pyrazol-3-yl)-3,4,5-trimethyl-benzamide CAS Name: N-(4-acetamido-4-anilino-5-oxo-1-phenyl-3-pyrazolyl)-3,4,5-trimethylbenzamide IUPAC Name: N-(4-acetamido-4-anilino-5-oxo-1-phenylpyrazol-3-yl)-3,4,5-trimethylbenzamide Traditional Name: N-(4-acetamido-4-anilino-5-keto-1-phenyl-2-pyrazolin-3-yl)-3,4,5-trimethyl-benzamide Formula: C27H27N5O3 MolecularWeight: 469.53498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)C)C(=O)NC2=NN(C(=O)C2(NC3=CC=CC=C3)NC(=O)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC(=C1C)C)C(=O)NC2=NN(C(=O)C2(NC3=CC=CC=C3)NC(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C27H27N5O3/c1-17-15-21(16-18(2)19(17)3)24(34)28-25-27(29-20(4)33,30-22-11-7-5-8-12-22)26(35)32(31-25)23-13-9-6-10-14-23/h5-16,30H,1-4H3,(H,29,33)(H,28,31,34)