methyl 2-(2-oxidanylidene-4-pyridin-2-ylsulfanyl-azetidin-1-yl)ethanoate

Systemtic Name: methyl 2-(2-oxidanylidene-4-pyridin-2-ylsulfanyl-azetidin-1-yl)ethanoate Openeye Name: methyl 2-[2-oxo-4-(2-pyridylsulfanyl)azetidin-1-yl]acetate CAS Name: 2-[2-oxo-4-(2-pyridinylthio)-1-azetidinyl]acetic acid methyl ester IUPAC Name: methyl 2-(2-oxo-4-pyridin-2-ylsulfanylazetidin-1-yl)acetate Traditional Name: 2-[2-keto-4-(2-pyridylthio)azetidin-1-yl]acetic acid methyl ester Formula: C11H12N2O3S MolecularWeight: 252.28958

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(CC1=O)SC2=CC=CC=N2

Isomeric SMILES

COC(=O)CN1C(CC1=O)SC2=CC=CC=N2

InChI

InChI=1S/C11H12N2O3S/c1-16-11(15)7-13-9(14)6-10(13)17-8-4-2-3-5-12-8/h2-5,10H,6-7H2,1H3