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

Systemtic Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1-(4-fluorophenyl)-5-methoxy-pyrazole-4-carboxamide Openeye Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1-(4-fluorophenyl)-5-methoxy-pyrazole-4-carboxamide CAS Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1-(4-fluorophenyl)-5-methoxy-4-pyrazolecarboxamide IUPAC Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-1-(4-fluorophenyl)-5-methoxypyrazole-4-carboxamide Traditional Name: N-(3-cyano-4-neopentyloxy-phenyl)-1-(4-fluorophenyl)-5-methoxy-pyrazole-4-carboxamide Formula: C23H23FN4O3 MolecularWeight: 422.452123

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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)OC)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)OC)C#N

InChI

InChI=1S/C23H23FN4O3/c1-23(2,3)14-31-20-10-7-17(11-15(20)12-25)27-21(29)19-13-26-28(22(19)30-4)18-8-5-16(24)6-9-18/h5-11,13H,14H2,1-4H3,(H,27,29)