3-[[(6-fluoranyl-1H-1,2,3-triazin-2-yl)amino]methyl]benzenesulfonic acid

Systemtic Name: 3-[[(6-fluoranyl-1H-1,2,3-triazin-2-yl)amino]methyl]benzenesulfonic acid Openeye Name: 3-[[(6-fluoro-1H-triazin-2-yl)amino]methyl]benzenesulfonic acid CAS Name: 3-[[(6-fluoro-1H-triazin-2-yl)amino]methyl]benzenesulfonic acid IUPAC Name: 3-[[(6-fluoro-1H-triazin-2-yl)amino]methyl]benzenesulfonic acid Traditional Name: 3-[[(6-fluoro-1H-triazin-2-yl)amino]methyl]besylic acid Formula: C10H11FN4O3S MolecularWeight: 286.282743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)O)CNN2NC(=CC=N2)F

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)O)CNN2NC(=CC=N2)F

InChI

InChI=1S/C10H11FN4O3S/c11-10-4-5-12-15(14-10)13-7-8-2-1-3-9(6-8)19(16,17)18/h1-6,13-14H,7H2,(H,16,17,18)