2-[4-ethoxy-2,3-bis(fluoranyl)phenyl]-5-(6-octoxypyridin-3-yl)pyrimidine

Systemtic Name: 2-[4-ethoxy-2,3-bis(fluoranyl)phenyl]-5-(6-octoxypyridin-3-yl)pyrimidine Openeye Name: 2-(4-ethoxy-2,3-difluoro-phenyl)-5-(6-octoxy-3-pyridyl)pyrimidine CAS Name: 2-(4-ethoxy-2,3-difluorophenyl)-5-(6-octoxy-3-pyridinyl)pyrimidine IUPAC Name: 2-(4-ethoxy-2,3-difluorophenyl)-5-(6-octoxypyridin-3-yl)pyrimidine Traditional Name: 2-(4-ethoxy-2,3-difluoro-phenyl)-5-(6-octoxy-3-pyridyl)pyrimidine Formula: C25H29F2N3O2 MolecularWeight: 441.513466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=NC=C(C=C1)C2=CN=C(N=C2)C3=C(C(=C(C=C3)OCC)F)F

Isomeric SMILES

CCCCCCCCOC1=NC=C(C=C1)C2=CN=C(N=C2)C3=C(C(=C(C=C3)OCC)F)F

InChI

InChI=1S/C25H29F2N3O2/c1-3-5-6-7-8-9-14-32-22-13-10-18(15-28-22)19-16-29-25(30-17-19)20-11-12-21(31-4-2)24(27)23(20)26/h10-13,15-17H,3-9,14H2,1-2H3