2-[[1-(2-cyanoethyl)-3-(4-phenylphenyl)pyrazol-4-yl]methylidene]propanedinitrile

Systemtic Name: 2-[[1-(2-cyanoethyl)-3-(4-phenylphenyl)pyrazol-4-yl]methylidene]propanedinitrile Openeye Name: 2-[[1-(2-cyanoethyl)-3-(4-phenylphenyl)pyrazol-4-yl]methylene]propanedinitrile CAS Name: 2-[[1-(2-cyanoethyl)-3-(4-phenylphenyl)-4-pyrazolyl]methylidene]propanedinitrile IUPAC Name: 2-[[1-(2-cyanoethyl)-3-(4-phenylphenyl)pyrazol-4-yl]methylidene]propanedinitrile Traditional Name: 2-[[1-(2-cyanoethyl)-3-(4-phenylphenyl)pyrazol-4-yl]methylene]malononitrile Formula: C22H15N5 MolecularWeight: 349.388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NN(C=C3C=C(C#N)C#N)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NN(C=C3C=C(C#N)C#N)CCC#N

InChI

InChI=1S/C22H15N5/c23-11-4-12-27-16-21(13-17(14-24)15-25)22(26-27)20-9-7-19(8-10-20)18-5-2-1-3-6-18/h1-3,5-10,13,16H,4,12H2