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

Systemtic Name: 2-[[1-(2-cyanoethyl)-3-(4-methylphenyl)pyrazol-4-yl]methylidene]propanedinitrile Openeye Name: 2-[[1-(2-cyanoethyl)-3-(p-tolyl)pyrazol-4-yl]methylene]propanedinitrile CAS Name: 2-[[1-(2-cyanoethyl)-3-(4-methylphenyl)-4-pyrazolyl]methylidene]propanedinitrile IUPAC Name: 2-[[1-(2-cyanoethyl)-3-(4-methylphenyl)pyrazol-4-yl]methylidene]propanedinitrile Traditional Name: 2-[[1-(2-cyanoethyl)-3-(p-tolyl)pyrazol-4-yl]methylene]malononitrile Formula: C17H13N5 MolecularWeight: 287.31862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C#N)CCC#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C#N)CCC#N

InChI

InChI=1S/C17H13N5/c1-13-3-5-15(6-4-13)17-16(9-14(10-19)11-20)12-22(21-17)8-2-7-18/h3-6,9,12H,2,8H2,1H3