[(4R,5S)-5-acetyloxy-1,3-diethanoyl-2-sulfanylidene-1,3-diazinan-4-yl]methyl ethanoate

Systemtic Name: [(4R,5S)-5-acetyloxy-1,3-diethanoyl-2-sulfanylidene-1,3-diazinan-4-yl]methyl ethanoate Openeye Name: [(4R,5S)-5-acetoxy-1,3-diacetyl-2-thioxo-hexahydropyrimidin-4-yl]methyl acetate CAS Name: acetic acid [(4R,5S)-1,3-diacetyl-5-acetyloxy-2-sulfanylidene-1,3-diazinan-4-yl]methyl ester IUPAC Name: [(4R,5S)-1,3-diacetyl-5-acetyloxy-2-sulfanylidene-1,3-diazinan-4-yl]methyl acetate Traditional Name: acetic acid [(4R,5S)-5-acetoxy-1,3-diacetyl-2-thioxo-hexahydropyrimidin-4-yl]methyl ester Formula: C13H18N2O6S MolecularWeight: 330.35682

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(C(N(C1=S)C(=O)C)COC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)N1C[C@@H]([C@H](N(C1=S)C(=O)C)COC(=O)C)OC(=O)C

InChI

InChI=1S/C13H18N2O6S/c1-7(16)14-5-12(21-10(4)19)11(6-20-9(3)18)15(8(2)17)13(14)22/h11-12H,5-6H2,1-4H3/t11-,12+/m1/s1