tert-butyl 5-(5-fluoranylpyrimidin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate

Systemtic Name: tert-butyl 5-(5-fluoranylpyrimidin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate Openeye Name: tert-butyl 5-(5-fluoropyrimidin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate CAS Name: 5-(5-fluoro-2-pyrimidinyl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-(5-fluoropyrimidin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate Traditional Name: 5-(5-fluoropyrimidin-2-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylic acid tert-butyl ester Formula: C14H19FN4O2 MolecularWeight: 294.324663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC2CC1CN2C3=NC=C(C=N3)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CC2CC1CN2C3=NC=C(C=N3)F

InChI

InChI=1S/C14H19FN4O2/c1-14(2,3)21-13(20)19-8-10-4-11(19)7-18(10)12-16-5-9(15)6-17-12/h5-6,10-11H,4,7-8H2,1-3H3