3-(2-pyridin-4-ylsulfanylethanoylamino)propanoic acid

Systemtic Name: 3-(2-pyridin-4-ylsulfanylethanoylamino)propanoic acid Openeye Name: 3-[[2-(4-pyridylsulfanyl)acetyl]amino]propanoic acid CAS Name: 3-[[1-oxo-2-(pyridin-4-ylthio)ethyl]amino]propanoic acid IUPAC Name: 3-[(2-pyridin-4-ylsulfanylacetyl)amino]propanoic acid Traditional Name: 3-[[2-(4-pyridylthio)acetyl]amino]propionic acid Formula: C10H12N2O3S MolecularWeight: 240.27888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1SCC(=O)NCCC(=O)O

Isomeric SMILES

C1=CN=CC=C1SCC(=O)NCCC(=O)O

InChI

InChI=1S/C10H12N2O3S/c13-9(12-6-3-10(14)15)7-16-8-1-4-11-5-2-8/h1-2,4-5H,3,6-7H2,(H,12,13)(H,14,15)