2-(2-pyridin-2-yl-4-pyridin-4-yl-pyrimidin-5-yl)-1,3-benzoxazole

Systemtic Name: 2-(2-pyridin-2-yl-4-pyridin-4-yl-pyrimidin-5-yl)-1,3-benzoxazole Openeye Name: 2-[2-(2-pyridyl)-4-(4-pyridyl)pyrimidin-5-yl]-1,3-benzoxazole CAS Name: 2-[2-(2-pyridinyl)-4-pyridin-4-yl-5-pyrimidinyl]-1,3-benzoxazole IUPAC Name: 2-(2-pyridin-2-yl-4-pyridin-4-ylpyrimidin-5-yl)-1,3-benzoxazole Traditional Name: 2-[2-(2-pyridyl)-4-(4-pyridyl)pyrimidin-5-yl]-1,3-benzoxazole Formula: C21H13N5O MolecularWeight: 351.36082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)C3=CN=C(N=C3C4=CC=NC=C4)C5=CC=CC=N5

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)C3=CN=C(N=C3C4=CC=NC=C4)C5=CC=CC=N5

InChI

InChI=1S/C21H13N5O/c1-2-7-18-16(5-1)25-21(27-18)15-13-24-20(17-6-3-4-10-23-17)26-19(15)14-8-11-22-12-9-14/h1-13H