5-chloranyl-N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1-(4-fluorophenyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1-(4-fluorophenyl)pyrazole-4-carboxamide Openeye Name: 5-chloro-N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1-(4-fluorophenyl)pyrazole-4-carboxamide CAS Name: 5-chloro-N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1-(4-fluorophenyl)-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1-(4-fluorophenyl)pyrazole-4-carboxamide Traditional Name: 5-chloro-N-(3-cyano-4-neopentyloxy-phenyl)-1-(4-fluorophenyl)pyrazole-4-carboxamide Formula: C22H20ClFN4O2 MolecularWeight: 426.871203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COC1=C(C=C(C=C1)NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)Cl)C#N

Isomeric SMILES

CC(C)(C)COC1=C(C=C(C=C1)NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)Cl)C#N

InChI

InChI=1S/C22H20ClFN4O2/c1-22(2,3)13-30-19-9-6-16(10-14(19)11-25)27-21(29)18-12-26-28(20(18)23)17-7-4-15(24)5-8-17/h4-10,12H,13H2,1-3H3,(H,27,29)