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

Systemtic Name: [2,4,6-tris(oxidanylidene)-3,5-bis[[4-oxidanyl-2-(sulfanylmethyl)butanoyl]oxy]-1,3,5-triazinan-1-yl] 4-oxidanyl-2-(sulfanylmethyl)butanoate Openeye Name: [3,5-bis[[4-hydroxy-2-(sulfanylmethyl)butanoyl]oxy]-2,4,6-trioxo-1,3,5-triazinan-1-yl] 4-hydroxy-2-(sulfanylmethyl)butanoate CAS Name: 4-hydroxy-2-(mercaptomethyl)butanoic acid [3,5-bis[4-hydroxy-2-(mercaptomethyl)-1-oxobutoxy]-2,4,6-trioxo-1,3,5-triazinan-1-yl] ester IUPAC Name: [3,5-bis[[4-hydroxy-2-(sulfanylmethyl)butanoyl]oxy]-2,4,6-trioxo-1,3,5-triazinan-1-yl] 4-hydroxy-2-(sulfanylmethyl)butanoate Traditional Name: 4-hydroxy-2-(mercaptomethyl)butyric acid [3,5-bis[[4-hydroxy-2-(mercaptomethyl)butanoyl]oxy]-2,4,6-triketo-1,3,5-triazinan-1-yl] ester Formula: C18H27N3O12S3 MolecularWeight: 573.61488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O12S3/c22-4-1-10(7-34)13(25)31-19-16(28)20(32-14(26)11(8-35)2-5-23)18(30)21(17(19)29)33-15(27)12(9-36)3-6-24/h10-12,22-24,34-36H,1-9H2