N-[3-cyano-4-(2-methylpropoxy)phenyl]-1-(4-fluorophenyl)-5-methyl-pyrazole-4-carboxamide

Systemtic Name: N-[3-cyano-4-(2-methylpropoxy)phenyl]-1-(4-fluorophenyl)-5-methyl-pyrazole-4-carboxamide Openeye Name: N-(3-cyano-4-isobutoxy-phenyl)-1-(4-fluorophenyl)-5-methyl-pyrazole-4-carboxamide CAS Name: N-[3-cyano-4-(2-methylpropoxy)phenyl]-1-(4-fluorophenyl)-5-methyl-4-pyrazolecarboxamide IUPAC Name: N-[3-cyano-4-(2-methylpropoxy)phenyl]-1-(4-fluorophenyl)-5-methylpyrazole-4-carboxamide Traditional Name: N-(3-cyano-4-isobutoxy-phenyl)-1-(4-fluorophenyl)-5-methyl-pyrazole-4-carboxamide Formula: C22H21FN4O2 MolecularWeight: 392.426143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NC3=CC(=C(C=C3)OCC(C)C)C#N

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NC3=CC(=C(C=C3)OCC(C)C)C#N

InChI

InChI=1S/C22H21FN4O2/c1-14(2)13-29-21-9-6-18(10-16(21)11-24)26-22(28)20-12-25-27(15(20)3)19-7-4-17(23)5-8-19/h4-10,12,14H,13H2,1-3H3,(H,26,28)