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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=NNC(=O)COC3=CC=CC=C3C#N)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2/C=N\NC(=O)COC3=CC=CC=C3C#N)CCC#N

InChI

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