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5-(azanylcarbamothioylamino)-2-oxidanyl-benzoic acid

5-(azanylcarbamothioylamino)-2-oxidanyl-benzoic acid

Systemtic Name:5-(azanylcarbamothioylamino)-2-oxidanyl-benzoic acid
Openeye Name:5-(aminocarbamothioylamino)-2-hydroxy-benzoic acid
CAS Name:5-[[hydrazinyl(sulfanylidene)methyl]amino]-2-hydroxybenzoic acid
IUPAC Name:5-(aminocarbamothioylamino)-2-hydroxybenzoic acid
Traditional Name:5-(aminothiocarbamoylamino)-2-hydroxy-benzoic acid
Formula: C8H9N3O3S
MolecularWeight: 227.24036
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=S)NN)C(=O)O)O


Isomeric SMILES

C1=CC(=C(C=C1NC(=S)NN)C(=O)O)O


InChI

InChI=1S/C8H9N3O3S/c9-11-8(15)10-4-1-2-6(12)5(3-4)7(13)14/h1-3,12H,9H2,(H,13,14)(H2,10,11,15)


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