4-phenyl-5-sulfanylidene-1,3,4-thiadiazole-2-sulfonic acid

Systemtic Name: 4-phenyl-5-sulfanylidene-1,3,4-thiadiazole-2-sulfonic acid Openeye Name: 4-phenyl-5-thioxo-1,3,4-thiadiazole-2-sulfonic acid CAS Name: 4-phenyl-5-sulfanylidene-1,3,4-thiadiazole-2-sulfonic acid IUPAC Name: 4-phenyl-5-sulfanylidene-1,3,4-thiadiazole-2-sulfonic acid Traditional Name: 4-phenyl-5-thioxo-1,3,4-thiadiazole-2-sulfonic acid Formula: C8H6N2O3S3 MolecularWeight: 274.33984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=S)SC(=N2)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=S)SC(=N2)S(=O)(=O)O

InChI

InChI=1S/C8H6N2O3S3/c11-16(12,13)7-9-10(8(14)15-7)6-4-2-1-3-5-6/h1-5H,(H,11,12,13)