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

Systemtic Name: 2-[[3-(4-bromophenyl)-1-(2-cyanoethyl)pyrazol-4-yl]methylidene]propanedinitrile Openeye Name: 2-[[3-(4-bromophenyl)-1-(2-cyanoethyl)pyrazol-4-yl]methylene]propanedinitrile CAS Name: 2-[[3-(4-bromophenyl)-1-(2-cyanoethyl)-4-pyrazolyl]methylidene]propanedinitrile IUPAC Name: 2-[[3-(4-bromophenyl)-1-(2-cyanoethyl)pyrazol-4-yl]methylidene]propanedinitrile Traditional Name: 2-[[3-(4-bromophenyl)-1-(2-cyanoethyl)pyrazol-4-yl]methylene]malononitrile Formula: C16H10BrN5 MolecularWeight: 352.1881

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C=C2C=C(C#N)C#N)CCC#N)Br

Isomeric SMILES

C1=CC(=CC=C1C2=NN(C=C2C=C(C#N)C#N)CCC#N)Br

InChI

InChI=1S/C16H10BrN5/c17-15-4-2-13(3-5-15)16-14(8-12(9-19)10-20)11-22(21-16)7-1-6-18/h2-5,8,11H,1,7H2