5-(4-bromophenyl)-N-tert-butyl-4-cyano-1-(2,4-dichlorophenyl)pyrazole-3-carboxamide

Systemtic Name: 5-(4-bromophenyl)-N-tert-butyl-4-cyano-1-(2,4-dichlorophenyl)pyrazole-3-carboxamide Openeye Name: 5-(4-bromophenyl)-N-tert-butyl-4-cyano-1-(2,4-dichlorophenyl)pyrazole-3-carboxamide CAS Name: 5-(4-bromophenyl)-N-tert-butyl-4-cyano-1-(2,4-dichlorophenyl)-3-pyrazolecarboxamide IUPAC Name: 5-(4-bromophenyl)-N-tert-butyl-4-cyano-1-(2,4-dichlorophenyl)pyrazole-3-carboxamide Traditional Name: 5-(4-bromophenyl)-N-tert-butyl-4-cyano-1-(2,4-dichlorophenyl)pyrazole-3-carboxamide Formula: C21H17BrCl2N4O MolecularWeight: 492.19588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=NN(C(=C1C#N)C2=CC=C(C=C2)Br)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1=NN(C(=C1C#N)C2=CC=C(C=C2)Br)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H17BrCl2N4O/c1-21(2,3)26-20(29)18-15(11-25)19(12-4-6-13(22)7-5-12)28(27-18)17-9-8-14(23)10-16(17)24/h4-10H,1-3H3,(H,26,29)