N-(4-cyano-2-methyl-pyrazol-3-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(4-cyano-2-methyl-3-pyrazolyl)-1-[(4-phenylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-cyano-2-methylpyrazol-3-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Formula: C22H18N6O2 MolecularWeight: 398.41732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C#N)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CN1C(=C(C=N1)C#N)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H18N6O2/c1-27-21(18(13-23)14-24-27)25-22(29)20-11-12-28(26-20)15-30-19-9-7-17(8-10-19)16-5-3-2-4-6-16/h2-12,14H,15H2,1H3,(H,25,29)