4-oxidanylidene-5-sulfanyl-1,3,5-triazine-2-carboxylic acid

Systemtic Name: 4-oxidanylidene-5-sulfanyl-1,3,5-triazine-2-carboxylic acid Openeye Name: 4-oxo-5-sulfanyl-1,3,5-triazine-2-carboxylic acid CAS Name: 5-mercapto-4-oxo-1,3,5-triazine-2-carboxylic acid IUPAC Name: 4-oxo-5-sulfanyl-1,3,5-triazine-2-carboxylic acid Traditional Name: 4-keto-5-mercapto-s-triazine-2-carboxylic acid Formula: C4H3N3O3S MolecularWeight: 173.14992

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=NC(=O)N1S)C(=O)O

Isomeric SMILES

C1=NC(=NC(=O)N1S)C(=O)O

InChI

InChI=1S/C4H3N3O3S/c8-3(9)2-5-1-7(11)4(10)6-2/h1,11H,(H,8,9)