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

Systemtic Name: 5-tert-butyl-2-[(2,4-dichlorophenyl)methyl]-N-phenyl-pyrazole-3-carboxamide Openeye Name: 5-tert-butyl-2-[(2,4-dichlorophenyl)methyl]-N-phenyl-pyrazole-3-carboxamide CAS Name: 5-tert-butyl-2-[(2,4-dichlorophenyl)methyl]-N-phenyl-3-pyrazolecarboxamide IUPAC Name: 5-tert-butyl-2-[(2,4-dichlorophenyl)methyl]-N-phenylpyrazole-3-carboxamide Traditional Name: 5-tert-butyl-2-(2,4-dichlorobenzyl)-N-phenyl-pyrazole-3-carboxamide Formula: C21H21Cl2N3O MolecularWeight: 402.31694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)NC2=CC=CC=C2)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)NC2=CC=CC=C2)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H21Cl2N3O/c1-21(2,3)19-12-18(20(27)24-16-7-5-4-6-8-16)26(25-19)13-14-9-10-15(22)11-17(14)23/h4-12H,13H2,1-3H3,(H,24,27)