4-[2,4-bis(fluoranyl)phenyl]-5-ethynyl-6-methoxy-pyrimidine

Systemtic Name: 4-[2,4-bis(fluoranyl)phenyl]-5-ethynyl-6-methoxy-pyrimidine Openeye Name: 4-(2,4-difluorophenyl)-5-ethynyl-6-methoxy-pyrimidine CAS Name: 4-(2,4-difluorophenyl)-5-ethynyl-6-methoxypyrimidine IUPAC Name: 4-(2,4-difluorophenyl)-5-ethynyl-6-methoxypyrimidine Traditional Name: 4-(2,4-difluorophenyl)-5-ethynyl-6-methoxy-pyrimidine Formula: C13H8F2N2O MolecularWeight: 246.212226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=NC(=C1C#C)C2=C(C=C(C=C2)F)F

Isomeric SMILES

COC1=NC=NC(=C1C#C)C2=C(C=C(C=C2)F)F

InChI

InChI=1S/C13H8F2N2O/c1-3-9-12(16-7-17-13(9)18-2)10-5-4-8(14)6-11(10)15/h1,4-7H,2H3