N-[4-(cyanomethoxy)phenyl]-5-(4-methoxyphenyl)-1-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-[4-(cyanomethoxy)phenyl]-5-(4-methoxyphenyl)-1-phenyl-pyrazole-3-carboxamide Openeye Name: N-[4-(cyanomethoxy)phenyl]-5-(4-methoxyphenyl)-1-phenyl-pyrazole-3-carboxamide CAS Name: N-[4-(cyanomethoxy)phenyl]-5-(4-methoxyphenyl)-1-phenyl-3-pyrazolecarboxamide IUPAC Name: N-[4-(cyanomethoxy)phenyl]-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide Traditional Name: N-[4-(cyanomethoxy)phenyl]-5-(4-methoxyphenyl)-1-phenyl-pyrazole-3-carboxamide Formula: C25H20N4O3 MolecularWeight: 424.4513

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NN2C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)OCC#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NN2C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)OCC#N

InChI

InChI=1S/C25H20N4O3/c1-31-21-11-7-18(8-12-21)24-17-23(28-29(24)20-5-3-2-4-6-20)25(30)27-19-9-13-22(14-10-19)32-16-15-26/h2-14,17H,16H2,1H3,(H,27,30)