sodium; benzenesulfonic acid; 1,3,4-triaza-2-azanidacyclopent-3-ene-5-thione

Systemtic Name: sodium; benzenesulfonic acid; 1,3,4-triaza-2-azanidacyclopent-3-ene-5-thione Openeye Name: sodium; benzenesulfonic acid; 1,3,4-triaza-2-azanidacyclopent-3-ene-5-thione CAS Name: sodium; benzenesulfonic acid; 1,3,4-triaza-2-azanidacyclopent-3-ene-5-thione IUPAC Name: sodium; benzenesulfonic acid; 1,3,4-triaza-2-azanidacyclopent-3-ene-5-thione Traditional Name: sodium; besylic acid; 1,3,4-triaza-2-azanidacyclopent-3-ene-5-thione Formula: C7H7N4NaO3S2 MolecularWeight: 282.27525

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)O.C1(=S)N[N-]N=N1.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)O.C1(=S)N[N-]N=N1.[Na+]

InChI

InChI=1S/C6H6O3S.CH2N4S.Na/c7-10(8,9)6-4-2-1-3-5-6;6-1-2-4-5-3-1;/h1-5H,(H,7,8,9);(H2,2,3,4,5,6);/q;;+1/p-1