4-chloranyl-3-[(6-fluoranyl-1,4-dihydro-1,3,5-triazin-2-yl)amino]benzenesulfonic acid

Systemtic Name: 4-chloranyl-3-[(6-fluoranyl-1,4-dihydro-1,3,5-triazin-2-yl)amino]benzenesulfonic acid Openeye Name: 4-chloro-3-[(6-fluoro-1,4-dihydro-1,3,5-triazin-2-yl)amino]benzenesulfonic acid CAS Name: 4-chloro-3-[(6-fluoro-1,4-dihydro-1,3,5-triazin-2-yl)amino]benzenesulfonic acid IUPAC Name: 4-chloro-3-[(6-fluoro-1,4-dihydro-1,3,5-triazin-2-yl)amino]benzenesulfonic acid Traditional Name: 4-chloro-3-[(6-fluoro-1,4-dihydro-s-triazin-2-yl)amino]besylic acid Formula: C9H8ClFN4O3S MolecularWeight: 306.701223

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Descriptors Computed from Structure

Canonical SMILES:

C1N=C(NC(=N1)F)NC2=C(C=CC(=C2)S(=O)(=O)O)Cl

Isomeric SMILES

C1N=C(NC(=N1)F)NC2=C(C=CC(=C2)S(=O)(=O)O)Cl

InChI

InChI=1S/C9H8ClFN4O3S/c10-6-2-1-5(19(16,17)18)3-7(6)14-9-13-4-12-8(11)15-9/h1-3H,4H2,(H,16,17,18)(H2,12,13,14,15)