2-[[5-methyl-4-(2-morpholin-4-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[5-methyl-4-(2-morpholin-4-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: 2-[[5-methyl-4-(2-morpholinoethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[5-methyl-4-[2-(4-morpholinyl)ethyl]-1,2,4-triazol-3-yl]thio]acetate IUPAC Name: 2-[[5-methyl-4-(2-morpholin-4-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[5-methyl-4-(2-morpholinoethyl)-1,2,4-triazol-3-yl]thio]acetate Formula: C11H17N4O3S- MolecularWeight: 285.34268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CCN2CCOCC2)SCC(=O)[O-]

Isomeric SMILES

CC1=NN=C(N1CCN2CCOCC2)SCC(=O)[O-]

InChI

InChI=1S/C11H18N4O3S/c1-9-12-13-11(19-8-10(16)17)15(9)3-2-14-4-6-18-7-5-14/h2-8H2,1H3,(H,16,17)/p-1