2-azanyl-4-[(6-chloranyl-4-oxidanylidene-1H-1,3,5-triazin-2-yl)amino]benzenesulfonic acid

Systemtic Name: 2-azanyl-4-[(6-chloranyl-4-oxidanylidene-1H-1,3,5-triazin-2-yl)amino]benzenesulfonic acid Openeye Name: 2-amino-4-[(6-chloro-4-oxo-1H-1,3,5-triazin-2-yl)amino]benzenesulfonic acid CAS Name: 2-amino-4-[(6-chloro-4-oxo-1H-1,3,5-triazin-2-yl)amino]benzenesulfonic acid IUPAC Name: 2-amino-4-[(6-chloro-4-oxo-1H-1,3,5-triazin-2-yl)amino]benzenesulfonic acid Traditional Name: 2-amino-4-[(6-chloro-4-keto-1H-s-triazin-2-yl)amino]besylic acid Formula: C9H8ClN5O4S MolecularWeight: 317.70892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=NC(=O)N=C(N2)Cl)N)S(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1NC2=NC(=O)N=C(N2)Cl)N)S(=O)(=O)O

InChI

InChI=1S/C9H8ClN5O4S/c10-7-13-8(15-9(16)14-7)12-4-1-2-6(5(11)3-4)20(17,18)19/h1-3H,11H2,(H,17,18,19)(H2,12,13,14,15,16)