2-[1-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoyl]piperidin-4-yl]ethanoic acid

Systemtic Name: 2-[1-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoyl]piperidin-4-yl]ethanoic acid Openeye Name: 2-[1-[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]-4-piperidyl]acetic acid CAS Name: 2-[1-[1-oxo-2-(1H-1,2,4-triazol-5-ylthio)ethyl]-4-piperidinyl]acetic acid IUPAC Name: 2-[1-[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]piperidin-4-yl]acetic acid Traditional Name: 2-[1-[2-(1H-1,2,4-triazol-5-ylthio)acetyl]-4-piperidyl]acetic acid Formula: C11H16N4O3S MolecularWeight: 284.33474

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC(=O)O)C(=O)CSC2=NC=NN2

Isomeric SMILES

C1CN(CCC1CC(=O)O)C(=O)CSC2=NC=NN2

InChI

InChI=1S/C11H16N4O3S/c16-9(6-19-11-12-7-13-14-11)15-3-1-8(2-4-15)5-10(17)18/h7-8H,1-6H2,(H,17,18)(H,12,13,14)