S-[4-oxidanylidene-3-(2-phenoxyethanoylamino)azetidin-2-yl] ethanethioate

Systemtic Name: S-[4-oxidanylidene-3-(2-phenoxyethanoylamino)azetidin-2-yl] ethanethioate Openeye Name: S-[4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-2-yl] ethanethioate CAS Name: ethanethioic acid S-[4-oxo-3-[(1-oxo-2-phenoxyethyl)amino]-2-azetidinyl] ester IUPAC Name: S-[4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-2-yl] ethanethioate Traditional Name: ethanethioic acid S-[4-keto-3-[(2-phenoxyacetyl)amino]azetidin-2-yl] ester Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1C(C(=O)N1)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CC(=O)SC1C(C(=O)N1)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C13H14N2O4S/c1-8(16)20-13-11(12(18)15-13)14-10(17)7-19-9-5-3-2-4-6-9/h2-6,11,13H,7H2,1H3,(H,14,17)(H,15,18)