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

Systemtic Name: 2-[[5-(3-ethylmorpholin-4-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[5-(3-ethylmorpholin-4-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[5-(3-ethyl-4-morpholinyl)-4-methyl-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[5-(3-ethylmorpholin-4-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[5-(3-ethylmorpholino)-4-methyl-1,2,4-triazol-3-yl]thio]acetic acid Formula: C11H18N4O3S MolecularWeight: 286.35062

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Descriptors Computed from Structure

Canonical SMILES:

CCC1COCCN1C2=NN=C(N2C)SCC(=O)O

Isomeric SMILES

CCC1COCCN1C2=NN=C(N2C)SCC(=O)O

InChI

InChI=1S/C11H18N4O3S/c1-3-8-6-18-5-4-15(8)10-12-13-11(14(10)2)19-7-9(16)17/h8H,3-7H2,1-2H3,(H,16,17)