2-[4-(4-fluorophenyl)-5-(2-phenoxypyrimidin-4-yl)-1,2,3-triazol-1-yl]ethanamine

Systemtic Name: 2-[4-(4-fluorophenyl)-5-(2-phenoxypyrimidin-4-yl)-1,2,3-triazol-1-yl]ethanamine Openeye Name: 2-[4-(4-fluorophenyl)-5-(2-phenoxypyrimidin-4-yl)triazol-1-yl]ethanamine CAS Name: 2-[4-(4-fluorophenyl)-5-(2-phenoxy-4-pyrimidinyl)-1-triazolyl]ethanamine IUPAC Name: 2-[4-(4-fluorophenyl)-5-(2-phenoxypyrimidin-4-yl)triazol-1-yl]ethanamine Traditional Name: 2-[4-(4-fluorophenyl)-5-(2-phenoxypyrimidin-4-yl)triazol-1-yl]ethylamine Formula: C20H17FN6O MolecularWeight: 376.386983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=NC=CC(=N2)C3=C(N=NN3CCN)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)OC2=NC=CC(=N2)C3=C(N=NN3CCN)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H17FN6O/c21-15-8-6-14(7-9-15)18-19(27(13-11-22)26-25-18)17-10-12-23-20(24-17)28-16-4-2-1-3-5-16/h1-10,12H,11,13,22H2