Vitas-M small molecule compound

5-(dibutylsulfonio)-1-hexyl-4-hydroxy-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-5-ide

Catalog ID
STL043903
SMILES CCCCCCN1C(=O)N=C([C-](C1=O)[S+](CCCC)CCCC)O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C18H32N2O3S MW 356.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H32N2O3S/c1-4-7-10-11-12-20-17(22)15(16(21)19-18(20)23)24(13-8-5-2)14-9-6-3/h4-14H2,1-3H3,(H,19,21,23)
InChIKey
MOXFGXPEEZNAMC-UHFFFAOYSA-N
Synonyms
1045863-00-0
1045863000
5(dibutyl$l^(4)sulfanylidene)1hexyl13diazinane246trione
5(dibutylsulfonio)1hexyl4hydroxy26dioxo1256tetrahydropyrimidin5ide
CCCCCCN1C(=O)C(=S(CCCC)CCCC)C(=O)NC1=O
CCCCCCN1C(=O)N=C((C)(C1=O)(S+)(CCCC)CCCC)O
InChI=1SC18H32N2O3Sc1471011122017(22)15(16(21)1918(20)23)24(13852)14963h414H213H3(H192123)
MFCD04080013
ZINC000013751528
ZINC13751528

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.