5-[(4-azanyl-5-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylic acid

Systemtic Name: 5-[(4-azanyl-5-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylic acid Openeye Name: 5-[(4-amino-5-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylic acid CAS Name: 5-[[(4-amino-5-ethyl-1,2,4-triazol-3-yl)thio]methyl]-2-furancarboxylic acid IUPAC Name: 5-[(4-amino-5-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylic acid Traditional Name: 5-[[(4-amino-5-ethyl-1,2,4-triazol-3-yl)thio]methyl]-2-furoic acid Formula: C10H12N4O3S MolecularWeight: 268.29228

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1N)SCC2=CC=C(O2)C(=O)O

Isomeric SMILES

CCC1=NN=C(N1N)SCC2=CC=C(O2)C(=O)O

InChI

InChI=1S/C10H12N4O3S/c1-2-8-12-13-10(14(8)11)18-5-6-3-4-7(17-6)9(15)16/h3-4H,2,5,11H2,1H3,(H,15,16)