ethyl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-(2-hydroxyethylsulfanylmethyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-(2-hydroxyethylsulfanylmethyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-hydroxyethylsulfanylmethyl)triazole-4-carboxylate CAS Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(2-hydroxyethylthio)methyl]-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-hydroxyethylsulfanylmethyl)triazole-4-carboxylate Traditional Name: 1-(4-aminofurazan-3-yl)-5-[(2-hydroxyethylthio)methyl]triazole-4-carboxylic acid ethyl ester Formula: C10H14N6O4S MolecularWeight: 314.32096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)C2=NON=C2N)CSCCO

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)C2=NON=C2N)CSCCO

InChI

InChI=1S/C10H14N6O4S/c1-2-19-10(18)7-6(5-21-4-3-17)16(15-12-7)9-8(11)13-20-14-9/h17H,2-5H2,1H3,(H2,11,13)