2-[(4-fluoranyl-1,4-dihydro-1,3,5-triazin-2-yl)amino]ethanesulfonic acid

Systemtic Name: 2-[(4-fluoranyl-1,4-dihydro-1,3,5-triazin-2-yl)amino]ethanesulfonic acid Openeye Name: 2-[(4-fluoro-1,4-dihydro-1,3,5-triazin-2-yl)amino]ethanesulfonic acid CAS Name: 2-[(4-fluoro-1,4-dihydro-1,3,5-triazin-2-yl)amino]ethanesulfonic acid IUPAC Name: 2-[(4-fluoro-1,4-dihydro-1,3,5-triazin-2-yl)amino]ethanesulfonic acid Traditional Name: 2-[(4-fluoro-1,4-dihydro-s-triazin-2-yl)amino]ethanesulfonic acid Formula: C5H9FN4O3S MolecularWeight: 224.213363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC(N=C(N1)NCCS(=O)(=O)O)F

Isomeric SMILES

C1=NC(N=C(N1)NCCS(=O)(=O)O)F

InChI

InChI=1S/C5H9FN4O3S/c6-4-8-3-9-5(10-4)7-1-2-14(11,12)13/h3-4H,1-2H2,(H,11,12,13)(H2,7,8,9,10)