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

Systemtic Name: methyl 5-[(4-azanyl-5-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[(4-amino-5-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(4-amino-5-ethyl-1,2,4-triazol-3-yl)thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-amino-5-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(4-amino-5-ethyl-1,2,4-triazol-3-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C11H14N4O3S MolecularWeight: 282.31886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N4O3S/c1-3-9-13-14-11(15(9)12)19-6-7-4-5-8(18-7)10(16)17-2/h4-5H,3,6,12H2,1-2H3