4-[[4-[[4-[(E)-2-cyanoethenyl]phenyl]amino]pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-[[4-[(E)-2-cyanoethenyl]phenyl]amino]pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-[4-[(E)-2-cyanovinyl]anilino]pyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[4-[4-[(E)-2-cyanoethenyl]anilino]-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-[4-[(E)-2-cyanoethenyl]anilino]pyrimidin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-[4-[(E)-2-cyanovinyl]anilino]pyrimidin-2-yl]amino]benzonitrile Formula: C20H14N6 MolecularWeight: 338.36536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC#N)NC2=NC(=NC=C2)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC(=CC=C1/C=C/C#N)NC2=NC(=NC=C2)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H14N6/c21-12-1-2-15-3-7-17(8-4-15)24-19-11-13-23-20(26-19)25-18-9-5-16(14-22)6-10-18/h1-11,13H,(H2,23,24,25,26)/b2-1+