S-ethyl 5-[(2R,3S,4R)-3,4-bis(oxidanyl)pyrrolidin-2-yl]-2-methyl-furan-3-carbothioate

Systemtic Name: S-ethyl 5-[(2R,3S,4R)-3,4-bis(oxidanyl)pyrrolidin-2-yl]-2-methyl-furan-3-carbothioate Openeye Name: S-ethyl 5-[(2R,3S,4R)-3,4-dihydroxypyrrolidin-2-yl]-2-methyl-furan-3-carbothioate CAS Name: 5-[(2R,3S,4R)-3,4-dihydroxy-2-pyrrolidinyl]-2-methyl-3-furancarbothioic acid S-ethyl ester IUPAC Name: S-ethyl 5-[(2R,3S,4R)-3,4-dihydroxypyrrolidin-2-yl]-2-methylfuran-3-carbothioate Traditional Name: 5-[(2R,3S,4R)-3,4-dihydroxypyrrolidin-2-yl]-2-methyl-furan-3-carbothioic acid S-ethyl ester Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C1=C(OC(=C1)C2C(C(CN2)O)O)C

Isomeric SMILES

CCSC(=O)C1=C(OC(=C1)[C@H]2[C@@H]([C@@H](CN2)O)O)C

InChI

InChI=1S/C12H17NO4S/c1-3-18-12(16)7-4-9(17-6(7)2)10-11(15)8(14)5-13-10/h4,8,10-11,13-15H,3,5H2,1-2H3/t8-,10+,11-/m1/s1