2,4-bis(2-fluoranyl-6-octoxy-pyridin-3-yl)pyrimidine

Systemtic Name: 2,4-bis(2-fluoranyl-6-octoxy-pyridin-3-yl)pyrimidine Openeye Name: 2,4-bis(2-fluoro-6-octoxy-3-pyridyl)pyrimidine CAS Name: 2,4-bis(2-fluoro-6-octoxy-3-pyridinyl)pyrimidine IUPAC Name: 2,4-bis(2-fluoro-6-octoxypyridin-3-yl)pyrimidine Traditional Name: 2,4-bis(2-fluoro-6-octoxy-3-pyridyl)pyrimidine Formula: C30H40F2N4O2 MolecularWeight: 526.661006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=NC(=C(C=C1)C2=NC(=NC=C2)C3=C(N=C(C=C3)OCCCCCCCC)F)F

Isomeric SMILES

CCCCCCCCOC1=NC(=C(C=C1)C2=NC(=NC=C2)C3=C(N=C(C=C3)OCCCCCCCC)F)F

InChI

InChI=1S/C30H40F2N4O2/c1-3-5-7-9-11-13-21-37-26-17-15-23(28(31)35-26)25-19-20-33-30(34-25)24-16-18-27(36-29(24)32)38-22-14-12-10-8-6-4-2/h15-20H,3-14,21-22H2,1-2H3