S-[4-oxidanylidene-3-(1-prop-2-enoxycarbonyloxyethyl)azetidin-2-yl] pyridine-3-carbothioate

Systemtic Name: S-[4-oxidanylidene-3-(1-prop-2-enoxycarbonyloxyethyl)azetidin-2-yl] pyridine-3-carbothioate Openeye Name: S-[3-(1-allyloxycarbonyloxyethyl)-4-oxo-azetidin-2-yl] pyridine-3-carbothioate CAS Name: 3-pyridinecarbothioic acid S-[4-oxo-3-[1-[oxo(prop-2-enoxy)methoxy]ethyl]-2-azetidinyl] ester IUPAC Name: S-[4-oxo-3-(1-prop-2-enoxycarbonyloxyethyl)azetidin-2-yl] pyridine-3-carbothioate Traditional Name: pyridine-3-carbothioic acid S-[3-(1-allyloxycarbonyloxyethyl)-4-keto-azetidin-2-yl] ester Formula: C15H16N2O5S MolecularWeight: 336.36294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(NC1=O)SC(=O)C2=CN=CC=C2)OC(=O)OCC=C

Isomeric SMILES

CC(C1C(NC1=O)SC(=O)C2=CN=CC=C2)OC(=O)OCC=C

InChI

InChI=1S/C15H16N2O5S/c1-3-7-21-15(20)22-9(2)11-12(18)17-13(11)23-14(19)10-5-4-6-16-8-10/h3-6,8-9,11,13H,1,7H2,2H3,(H,17,18)