5-azanyl-4-sulfanylidene-cyclohexa-1,5-diene-1-carboxylic acid

Systemtic Name: 5-azanyl-4-sulfanylidene-cyclohexa-1,5-diene-1-carboxylic acid Openeye Name: 5-amino-4-thioxo-cyclohexa-1,5-diene-1-carboxylic acid CAS Name: 5-amino-4-sulfanylidene-1-cyclohexa-1,5-dienecarboxylic acid IUPAC Name: 5-amino-4-sulfanylidenecyclohexa-1,5-diene-1-carboxylic acid Traditional Name: 5-amino-4-thioxo-cyclohexa-1,5-diene-1-carboxylic acid Formula: C7H7NO2S MolecularWeight: 169.20098

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C=C(C1=S)N)C(=O)O

Isomeric SMILES

C1C=C(C=C(C1=S)N)C(=O)O

InChI

InChI=1S/C7H7NO2S/c8-5-3-4(7(9)10)1-2-6(5)11/h1,3H,2,8H2,(H,9,10)