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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CCNC(=O)C)SCC(=O)O

Isomeric SMILES

CC1=NN=C(N1CCNC(=O)C)SCC(=O)O

InChI

InChI=1S/C9H14N4O3S/c1-6-11-12-9(17-5-8(15)16)13(6)4-3-10-7(2)14/h3-5H2,1-2H3,(H,10,14)(H,15,16)