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

Systemtic Name: 2-[[4-(2-acetamidoethyl)-5-ethyl-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[4-(2-acetamidoethyl)-5-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[4-(2-acetamidoethyl)-5-ethyl-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[4-(2-acetamidoethyl)-5-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[4-(2-acetamidoethyl)-5-ethyl-1,2,4-triazol-3-yl]thio]acetic acid Formula: C10H16N4O3S MolecularWeight: 272.32404

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1CCNC(=O)C)SCC(=O)O

Isomeric SMILES

CCC1=NN=C(N1CCNC(=O)C)SCC(=O)O

InChI

InChI=1S/C10H16N4O3S/c1-3-8-12-13-10(18-6-9(16)17)14(8)5-4-11-7(2)15/h3-6H2,1-2H3,(H,11,15)(H,16,17)