(3aR,6aS)-5-methyl-2-[2-(phenylsulfonyl)ethyl]spiro[3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-3,3'-thiolane]-4,6-dione

Systemtic Name: (3aR,6aS)-5-methyl-2-[2-(phenylsulfonyl)ethyl]spiro[3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-3,3'-thiolane]-4,6-dione Openeye Name: (3aR,6aS)-2-[2-(benzenesulfonyl)ethyl]-5-methyl-spiro[3a,6a-dihydropyrrolo[3,4-d]isoxazole-3,3'-tetrahydrothiophene]-4,6-dione CAS Name: (3aR,6aS)-2-[2-(benzenesulfonyl)ethyl]-5-methylspiro[3a,6a-dihydropyrrolo[3,4-d]isoxazole-3,3'-thiolane]-4,6-dione IUPAC Name: (3aR,6aS)-2-[2-(benzenesulfonyl)ethyl]-5-methylspiro[3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-3,3'-thiolane]-4,6-dione Traditional Name: (3aR,6aS)-2-(2-besylethyl)-5-methyl-spiro[3a,6a-dihydropyrrol[3,4-d]isoxazole-3,3'-tetrahydrothiophene]-4,6-quinone Formula: C17H20N2O5S2 MolecularWeight: 396.4811

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2C(C1=O)ON(C23CCSC3)CCS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN1C(=O)[C@H]2[C@@H](C1=O)ON(C23CCSC3)CCS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C17H20N2O5S2/c1-18-15(20)13-14(16(18)21)24-19(17(13)7-9-25-11-17)8-10-26(22,23)12-5-3-2-4-6-12/h2-6,13-14H,7-11H2,1H3/t13-,14+,17?/m1/s1