5-(3-methoxy-3-oxidanylidene-propyl)sulfanyl-1,2,3-thiadiazole-4-carboxylic acid

Systemtic Name: 5-(3-methoxy-3-oxidanylidene-propyl)sulfanyl-1,2,3-thiadiazole-4-carboxylic acid Openeye Name: 5-(3-methoxy-3-oxo-propyl)sulfanylthiadiazole-4-carboxylic acid CAS Name: 5-[(3-methoxy-3-oxopropyl)thio]-4-thiadiazolecarboxylic acid IUPAC Name: 5-(3-methoxy-3-oxopropyl)sulfanylthiadiazole-4-carboxylic acid Traditional Name: 5-[(3-keto-3-methoxy-propyl)thio]thiadiazole-4-carboxylic acid Formula: C7H8N2O4S2 MolecularWeight: 248.27942

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=C(N=NS1)C(=O)O

Isomeric SMILES

COC(=O)CCSC1=C(N=NS1)C(=O)O

InChI

InChI=1S/C7H8N2O4S2/c1-13-4(10)2-3-14-7-5(6(11)12)8-9-15-7/h2-3H2,1H3,(H,11,12)