4-[(4-azanyl-6-chloranyl-1,3,5-triazin-2-yl)amino]cyclohexa-2,4-diene-1-sulfonic acid

Systemtic Name: 4-[(4-azanyl-6-chloranyl-1,3,5-triazin-2-yl)amino]cyclohexa-2,4-diene-1-sulfonic acid Openeye Name: 4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]cyclohexa-2,4-diene-1-sulfonic acid CAS Name: 4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-1-cyclohexa-2,4-dienesulfonic acid IUPAC Name: 4-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]cyclohexa-2,4-diene-1-sulfonic acid Traditional Name: 4-[(4-amino-6-chloro-s-triazin-2-yl)amino]cyclohexa-2,4-diene-1-sulfonic acid Formula: C9H10ClN5O3S MolecularWeight: 303.7254

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C=CC1S(=O)(=O)O)NC2=NC(=NC(=N2)N)Cl

Isomeric SMILES

C1C=C(C=CC1S(=O)(=O)O)NC2=NC(=NC(=N2)N)Cl

InChI

InChI=1S/C9H10ClN5O3S/c10-7-13-8(11)15-9(14-7)12-5-1-3-6(4-2-5)19(16,17)18/h1-3,6H,4H2,(H,16,17,18)(H3,11,12,13,14,15)