methyl 3-oxidanyl-2-[(2-propylsulfanylpyridin-3-yl)carbonylamino]propanoate

Systemtic Name: methyl 3-oxidanyl-2-[(2-propylsulfanylpyridin-3-yl)carbonylamino]propanoate Openeye Name: methyl 3-hydroxy-2-[(2-propylsulfanylpyridine-3-carbonyl)amino]propanoate CAS Name: 3-hydroxy-2-[[oxo-[2-(propylthio)-3-pyridinyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[(2-propylsulfanylpyridine-3-carbonyl)amino]propanoate Traditional Name: 3-hydroxy-2-[[2-(propylthio)nicotinoyl]amino]propionic acid methyl ester Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C=CC=N1)C(=O)NC(CO)C(=O)OC

Isomeric SMILES

CCCSC1=C(C=CC=N1)C(=O)NC(CO)C(=O)OC

InChI

InChI=1S/C13H18N2O4S/c1-3-7-20-12-9(5-4-6-14-12)11(17)15-10(8-16)13(18)19-2/h4-6,10,16H,3,7-8H2,1-2H3,(H,15,17)