4-azanylbenzenesulfonic acid; 1H-1,2,4-triazol-5-amine

Systemtic Name: 4-azanylbenzenesulfonic acid; 1H-1,2,4-triazol-5-amine Openeye Name: 4-aminobenzenesulfonic acid; 1H-1,2,4-triazol-5-amine CAS Name: 4-aminobenzenesulfonic acid; 1H-1,2,4-triazol-5-amine IUPAC Name: 4-aminobenzenesulfonic acid; 1H-1,2,4-triazol-5-amine Traditional Name: 4-aminobesylic acid; 1H-1,2,4-triazol-5-ylamine Formula: C8H11N5O3S MolecularWeight: 257.26964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)S(=O)(=O)O.C1=NNC(=N1)N

Isomeric SMILES

C1=CC(=CC=C1N)S(=O)(=O)O.C1=NNC(=N1)N

InChI

InChI=1S/C6H7NO3S.C2H4N4/c7-5-1-3-6(4-2-5)11(8,9)10;3-2-4-1-5-6-2/h1-4H,7H2,(H,8,9,10);1H,(H3,3,4,5,6)