[4-[2-(cyanoamino)-5-ethyl-6-phenyl-pyrimidin-4-yl]-5-ethyl-6-phenyl-pyrimidin-2-yl]cyanamide

Systemtic Name: [4-[2-(cyanoamino)-5-ethyl-6-phenyl-pyrimidin-4-yl]-5-ethyl-6-phenyl-pyrimidin-2-yl]cyanamide Openeye Name: [4-[2-(cyanoamino)-5-ethyl-6-phenyl-pyrimidin-4-yl]-5-ethyl-6-phenyl-pyrimidin-2-yl]cyanamide CAS Name: [4-[2-(cyanoamino)-5-ethyl-6-phenyl-4-pyrimidinyl]-5-ethyl-6-phenyl-2-pyrimidinyl]cyanamide IUPAC Name: [4-[2-(cyanoamino)-5-ethyl-6-phenylpyrimidin-4-yl]-5-ethyl-6-phenylpyrimidin-2-yl]cyanamide Traditional Name: [4-[2-(cyanoamino)-5-ethyl-6-phenyl-pyrimidin-4-yl]-5-ethyl-6-phenyl-pyrimidin-2-yl]cyanamide Formula: C26H22N8 MolecularWeight: 446.50648

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1C2=NC(=NC(=C2CC)C3=CC=CC=C3)NC#N)NC#N)C4=CC=CC=C4

Isomeric SMILES

CCC1=C(N=C(N=C1C2=NC(=NC(=C2CC)C3=CC=CC=C3)NC#N)NC#N)C4=CC=CC=C4

InChI

InChI=1S/C26H22N8/c1-3-19-21(17-11-7-5-8-12-17)31-25(29-15-27)33-23(19)24-20(4-2)22(18-13-9-6-10-14-18)32-26(34-24)30-16-28/h5-14H,3-4H2,1-2H3,(H,29,31,33)(H,30,32,34)