[(3R,4S,6R)-5-acetamido-3,4-diacetyloxy-6-ethoxycarbothioylsulfanyl-oxan-2-yl]methyl ethanoate

Systemtic Name: [(3R,4S,6R)-5-acetamido-3,4-diacetyloxy-6-ethoxycarbothioylsulfanyl-oxan-2-yl]methyl ethanoate Openeye Name: [(3R,4S,6R)-5-acetamido-3,4-diacetoxy-6-ethoxycarbothioylsulfanyl-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(3R,4S,6R)-5-acetamido-3,4-diacetyloxy-6-[[ethoxy(sulfanylidene)methyl]thio]-2-oxanyl]methyl ester IUPAC Name: [(3R,4S,6R)-5-acetamido-3,4-diacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl]methyl acetate Traditional Name: acetic acid [(3R,4S,6R)-5-acetamido-3,4-diacetoxy-6-(ethoxycarbothioylthio)tetrahydropyran-2-yl]methyl ester Formula: C17H25NO9S2 MolecularWeight: 451.5117

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SC1C(C(C(C(O1)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C

Isomeric SMILES

CCOC(=S)S[C@@H]1C([C@@H]([C@H](C(O1)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C

InChI

InChI=1S/C17H25NO9S2/c1-6-23-17(28)29-16-13(18-8(2)19)15(26-11(5)22)14(25-10(4)21)12(27-16)7-24-9(3)20/h12-16H,6-7H2,1-5H3,(H,18,19)/t12?,13?,14-,15-,16+/m0/s1