[2,4,6-tris(oxidanylidene)-3,5-bis[(4-oxidanyl-2-sulfanyl-butanoyl)oxy]-1,3,5-triazinan-1-yl] 4-oxidanyl-2-sulfanyl-butanoate

Systemtic Name: [2,4,6-tris(oxidanylidene)-3,5-bis[(4-oxidanyl-2-sulfanyl-butanoyl)oxy]-1,3,5-triazinan-1-yl] 4-oxidanyl-2-sulfanyl-butanoate Openeye Name: [3,5-bis[(4-hydroxy-2-sulfanyl-butanoyl)oxy]-2,4,6-trioxo-1,3,5-triazinan-1-yl] 4-hydroxy-2-sulfanyl-butanoate CAS Name: 4-hydroxy-2-mercaptobutanoic acid [3,5-bis(4-hydroxy-2-mercapto-1-oxobutoxy)-2,4,6-trioxo-1,3,5-triazinan-1-yl] ester IUPAC Name: [3,5-bis[(4-hydroxy-2-sulfanylbutanoyl)oxy]-2,4,6-trioxo-1,3,5-triazinan-1-yl] 4-hydroxy-2-sulfanylbutanoate Traditional Name: 4-hydroxy-2-mercapto-butyric acid [3,5-bis[(4-hydroxy-2-mercapto-butanoyl)oxy]-2,4,6-triketo-1,3,5-triazinan-1-yl] ester Formula: C15H21N3O12S3 MolecularWeight: 531.53514

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Descriptors Computed from Structure

Canonical SMILES:

C(CO)C(C(=O)ON1C(=O)N(C(=O)N(C1=O)OC(=O)C(CCO)S)OC(=O)C(CCO)S)S

Isomeric SMILES

C(CO)C(C(=O)ON1C(=O)N(C(=O)N(C1=O)OC(=O)C(CCO)S)OC(=O)C(CCO)S)S

InChI

InChI=1S/C15H21N3O12S3/c19-4-1-7(31)10(22)28-16-13(25)17(29-11(23)8(32)2-5-20)15(27)18(14(16)26)30-12(24)9(33)3-6-21/h7-9,19-21,31-33H,1-6H2