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

Systemtic Name: 2-[(4-chloranyl-6-methoxy-1,3,5-triazin-2-yl)amino]-4-(methylsulfonylamino)benzenesulfonic acid Openeye Name: 2-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]-4-(methanesulfonamido)benzenesulfonic acid CAS Name: 2-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]-4-(methanesulfonamido)benzenesulfonic acid IUPAC Name: 2-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino]-4-(methanesulfonamido)benzenesulfonic acid Traditional Name: 2-[(4-chloro-6-methoxy-s-triazin-2-yl)amino]-4-(methanesulfonamido)besylic acid Formula: C11H12ClN5O6S2 MolecularWeight: 409.82588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12ClN5O6S2/c1-23-11-15-9(12)14-10(16-11)13-7-5-6(17-24(2,18)19)3-4-8(7)25(20,21)22/h3-5,17H,1-2H3,(H,20,21,22)(H,13,14,15,16)