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

Systemtic Name: 2-azanyl-4-[(4-chloranyl-6-methyl-1,3,5-triazin-2-yl)-methyl-amino]benzenesulfonic acid Openeye Name: 2-amino-4-[(4-chloro-6-methyl-1,3,5-triazin-2-yl)-methyl-amino]benzenesulfonic acid CAS Name: 2-amino-4-[(4-chloro-6-methyl-1,3,5-triazin-2-yl)-methylamino]benzenesulfonic acid IUPAC Name: 2-amino-4-[(4-chloro-6-methyl-1,3,5-triazin-2-yl)-methylamino]benzenesulfonic acid Traditional Name: 2-amino-4-[(4-chloro-6-methyl-s-triazin-2-yl)-methyl-amino]besylic acid Formula: C11H12ClN5O3S MolecularWeight: 329.76268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=N1)Cl)N(C)C2=CC(=C(C=C2)S(=O)(=O)O)N

Isomeric SMILES

CC1=NC(=NC(=N1)Cl)N(C)C2=CC(=C(C=C2)S(=O)(=O)O)N

InChI

InChI=1S/C11H12ClN5O3S/c1-6-14-10(12)16-11(15-6)17(2)7-3-4-9(8(13)5-7)21(18,19)20/h3-5H,13H2,1-2H3,(H,18,19,20)