5-[[4-azanyl-5-(methoxymethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]furan-2-carboxylate

Systemtic Name: 5-[[4-azanyl-5-(methoxymethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]furan-2-carboxylate Openeye Name: 5-[[4-amino-5-(methoxymethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[4-amino-5-(methoxymethyl)-1,2,4-triazol-3-yl]thio]methyl]-2-furancarboxylate IUPAC Name: 5-[[4-amino-5-(methoxymethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[[4-amino-5-(methoxymethyl)-1,2,4-triazol-3-yl]thio]methyl]-2-furoate Formula: C10H11N4O4S- MolecularWeight: 283.28374

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NN=C(N1N)SCC2=CC=C(O2)C(=O)[O-]

Isomeric SMILES

COCC1=NN=C(N1N)SCC2=CC=C(O2)C(=O)[O-]

InChI

InChI=1S/C10H12N4O4S/c1-17-4-8-12-13-10(14(8)11)19-5-6-2-3-7(18-6)9(15)16/h2-3H,4-5,11H2,1H3,(H,15,16)/p-1