S-phenyl 3-[(3S)-1-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-oxidanylidene-azetidin-3-yl]propanethioate

Systemtic Name: S-phenyl 3-[(3S)-1-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-oxidanylidene-azetidin-3-yl]propanethioate Openeye Name: S-phenyl 3-[(3S)-1-(1,3-dioxoisoindolin-2-yl)-2-oxo-azetidin-3-yl]propanethioate CAS Name: 3-[(3S)-1-(1,3-dioxo-2-isoindolyl)-2-oxo-3-azetidinyl]propanethioic acid S-phenyl ester IUPAC Name: S-phenyl 3-[(3S)-1-(1,3-dioxoisoindol-2-yl)-2-oxoazetidin-3-yl]propanethioate Traditional Name: 3-[(3S)-2-keto-1-phthalimido-azetidin-3-yl]propanethioic acid S-phenyl ester Formula: C20H16N2O4S MolecularWeight: 380.41704

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N1N2C(=O)C3=CC=CC=C3C2=O)CCC(=O)SC4=CC=CC=C4

Isomeric SMILES

C1[C@@H](C(=O)N1N2C(=O)C3=CC=CC=C3C2=O)CCC(=O)SC4=CC=CC=C4

InChI

InChI=1S/C20H16N2O4S/c23-17(27-14-6-2-1-3-7-14)11-10-13-12-21(18(13)24)22-19(25)15-8-4-5-9-16(15)20(22)26/h1-9,13H,10-12H2/t13-/m0/s1