5-tert-butyl-N-[4-chloranyl-3-(phenylcarbonyl)phenyl]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: 5-tert-butyl-N-[4-chloranyl-3-(phenylcarbonyl)phenyl]-2-methyl-pyrazole-3-carboxamide Openeye Name: N-(3-benzoyl-4-chloro-phenyl)-5-tert-butyl-2-methyl-pyrazole-3-carboxamide CAS Name: N-(3-benzoyl-4-chlorophenyl)-5-tert-butyl-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-(3-benzoyl-4-chlorophenyl)-5-tert-butyl-2-methylpyrazole-3-carboxamide Traditional Name: N-(3-benzoyl-4-chloro-phenyl)-5-tert-butyl-2-methyl-pyrazole-3-carboxamide Formula: C22H22ClN3O2 MolecularWeight: 395.88198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)NC2=CC(=C(C=C2)Cl)C(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)NC2=CC(=C(C=C2)Cl)C(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C22H22ClN3O2/c1-22(2,3)19-13-18(26(4)25-19)21(28)24-15-10-11-17(23)16(12-15)20(27)14-8-6-5-7-9-14/h5-13H,1-4H3,(H,24,28)