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

Systemtic Name: 2-azanyl-4-[(4-chloranyl-6-methoxy-1,3,5-triazin-2-yl)amino]benzenesulfonic acid Openeye Name: 2-amino-4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]benzenesulfonic acid CAS Name: 2-amino-4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]benzenesulfonic acid IUPAC Name: 2-amino-4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]benzenesulfonic acid Traditional Name: 2-amino-4-[(4-chloro-6-methoxy-s-triazin-2-yl)amino]besylic acid Formula: C10H10ClN5O4S MolecularWeight: 331.7355

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=N1)NC2=CC(=C(C=C2)S(=O)(=O)O)N)Cl

Isomeric SMILES

COC1=NC(=NC(=N1)NC2=CC(=C(C=C2)S(=O)(=O)O)N)Cl

InChI

InChI=1S/C10H10ClN5O4S/c1-20-10-15-8(11)14-9(16-10)13-5-2-3-7(6(12)4-5)21(17,18)19/h2-4H,12H2,1H3,(H,17,18,19)(H,13,14,15,16)