N-[(Z)-[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]methylideneamino]-2-(4-cyanophenoxy)ethanamide

Systemtic Name: N-[(Z)-[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]methylideneamino]-2-(4-cyanophenoxy)ethanamide Openeye Name: N-[(Z)-[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]methyleneamino]-2-(4-cyanophenoxy)acetamide CAS Name: N-[(Z)-[1-(2-cyanoethyl)-3-phenyl-4-pyrazolyl]methylideneamino]-2-(4-cyanophenoxy)acetamide IUPAC Name: N-[(Z)-[1-(2-cyanoethyl)-3-phenylpyrazol-4-yl]methylideneamino]-2-(4-cyanophenoxy)acetamide Traditional Name: N-[(Z)-[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]methyleneamino]-2-(4-cyanophenoxy)acetamide Formula: C22H18N6O2 MolecularWeight: 398.41732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=NNC(=O)COC3=CC=C(C=C3)C#N)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2/C=N\NC(=O)COC3=CC=C(C=C3)C#N)CCC#N

InChI

InChI=1S/C22H18N6O2/c23-11-4-12-28-15-19(22(27-28)18-5-2-1-3-6-18)14-25-26-21(29)16-30-20-9-7-17(13-24)8-10-20/h1-3,5-10,14-15H,4,12,16H2,(H,26,29)/b25-14-