5-[4-[(1R,2S)-2-azanyl-3-fluoranyl-1-methoxy-propyl]phenyl]pyrimidin-2-amine

Systemtic Name: 5-[4-[(1R,2S)-2-azanyl-3-fluoranyl-1-methoxy-propyl]phenyl]pyrimidin-2-amine Openeye Name: 5-[4-[(1R,2S)-2-amino-3-fluoro-1-methoxy-propyl]phenyl]pyrimidin-2-amine CAS Name: 5-[4-[(1R,2S)-2-amino-3-fluoro-1-methoxypropyl]phenyl]-2-pyrimidinamine IUPAC Name: 5-[4-[(1R,2S)-2-amino-3-fluoro-1-methoxypropyl]phenyl]pyrimidin-2-amine Traditional Name: [5-[4-[(1R,2S)-2-amino-3-fluoro-1-methoxy-propyl]phenyl]pyrimidin-2-yl]amine Formula: C14H17FN4O MolecularWeight: 276.309383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(C1=CC=C(C=C1)C2=CN=C(N=C2)N)C(CF)N

Isomeric SMILES

CO[C@H](C1=CC=C(C=C1)C2=CN=C(N=C2)N)[C@@H](CF)N

InChI

InChI=1S/C14H17FN4O/c1-20-13(12(16)6-15)10-4-2-9(3-5-10)11-7-18-14(17)19-8-11/h2-5,7-8,12-13H,6,16H2,1H3,(H2,17,18,19)/t12-,13-/m1/s1