4-[[4-[[4-[(E)-2-cyanoethenyl]-2-ethyl-6-methyl-phenyl]amino]pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-[[4-[(E)-2-cyanoethenyl]-2-ethyl-6-methyl-phenyl]amino]pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-[4-[(E)-2-cyanovinyl]-2-ethyl-6-methyl-anilino]pyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[4-[4-[(E)-2-cyanoethenyl]-2-ethyl-6-methylanilino]-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-[4-[(E)-2-cyanoethenyl]-2-ethyl-6-methylanilino]pyrimidin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-[4-[(E)-2-cyanovinyl]-2-ethyl-6-methyl-anilino]pyrimidin-2-yl]amino]benzonitrile Formula: C23H20N6 MolecularWeight: 380.4451

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1NC2=NC(=NC=C2)NC3=CC=C(C=C3)C#N)C)C=CC#N

Isomeric SMILES

CCC1=CC(=CC(=C1NC2=NC(=NC=C2)NC3=CC=C(C=C3)C#N)C)/C=C/C#N

InChI

InChI=1S/C23H20N6/c1-3-19-14-18(5-4-11-24)13-16(2)22(19)28-21-10-12-26-23(29-21)27-20-8-6-17(15-25)7-9-20/h4-10,12-14H,3H2,1-2H3,(H2,26,27,28,29)/b5-4+