5-tert-butyl-N-[3-(3,4-dichlorophenyl)carbonylphenyl]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: 5-tert-butyl-N-[3-(3,4-dichlorophenyl)carbonylphenyl]-2-methyl-pyrazole-3-carboxamide Openeye Name: 5-tert-butyl-N-[3-(3,4-dichlorobenzoyl)phenyl]-2-methyl-pyrazole-3-carboxamide CAS Name: 5-tert-butyl-N-[3-[(3,4-dichlorophenyl)-oxomethyl]phenyl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: 5-tert-butyl-N-[3-(3,4-dichlorobenzoyl)phenyl]-2-methylpyrazole-3-carboxamide Traditional Name: 5-tert-butyl-N-[3-(3,4-dichlorobenzoyl)phenyl]-2-methyl-pyrazole-3-carboxamide Formula: C22H21Cl2N3O2 MolecularWeight: 430.32704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21Cl2N3O2/c1-22(2,3)19-12-18(27(4)26-19)21(29)25-15-7-5-6-13(10-15)20(28)14-8-9-16(23)17(24)11-14/h5-12H,1-4H3,(H,25,29)