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

Systemtic Name: 2-[(4-methyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(4-methyl-5-morpholino-1,2,4-triazol-3-yl)sulfanyl]acetic acid CAS Name: 2-[[4-methyl-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[(4-methyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetic acid Traditional Name: 2-[(4-methyl-5-morpholino-1,2,4-triazol-3-yl)thio]acetic acid Formula: C9H14N4O3S MolecularWeight: 258.29746

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)O)N2CCOCC2

Isomeric SMILES

CN1C(=NN=C1SCC(=O)O)N2CCOCC2

InChI

InChI=1S/C9H14N4O3S/c1-12-8(13-2-4-16-5-3-13)10-11-9(12)17-6-7(14)15/h2-6H2,1H3,(H,14,15)