Vitas-M small molecule compound

ethyl 6-{5-[(acetylsulfanyl)methyl]-2-oxo-2,3-dihydro-1H-imidazol-4-yl}-6-oxohexanoate

Catalog ID
STL477102
SMILES CCOC(=O)CCCCC(=O)c1[nH]c(=O)[nH]c1CSC(=O)C

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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 C14H20N2O5S MW 328.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H20N2O5S/c1-3-21-12(19)7-5-4-6-11(18)13-10(8-22-9(2)17)15-14(20)16-13/h3-8H2,1-2H3,(H2,15,16,20)
InChIKey
MTPSGNOAJYFAKV-UHFFFAOYSA-N
Synonyms

CCOC(=O)CCCCC(=O)c1(nH)c(=O)(nH)c1CSC(=O)C
CCOC(=O)CCCCC(=O)C1=C(NC(=O)N1)CSC(=O)C
ethyl6(5((acetylsulfanyl)methyl)2oxo23dihydro1Himidazol4yl)6oxohexanoate
ETHYL6(5(ACETYLSULFANYLMETHYL)2OXO13DIHYDROIMIDAZOL4YL)6OXOHEXANOATE
InChI=1SC14H20N2O5Sc132112(19)754611(18)1310(8229(2)17)1514(20)1613h38H212H3(H2151620)
MFCD00233009
ZINC000020167570

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Available files

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