Vitas-M small molecule compound

methyl [(3-ethyl-4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate

Catalog ID
STK007354
SMILES COC(=O)CSc1nc2sc3c(c2c(=O)n1CC)CCC3

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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 C14H16N2O3S2 MW 324.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N2O3S2/c1-3-16-13(18)11-8-5-4-6-9(8)21-12(11)15-14(16)20-7-10(17)19-2/h3-7H2,1-2H3
InChIKey
AKIDQGCPFLJAFS-UHFFFAOYSA-N
Synonyms
356587-49-0
356587490
CCN1C(=O)C2=C(N=C1SCC(=O)OC)SC3=C2CCC3
COC(=O)CSc1nc2sc3c(c2c(=O)n1CC)CCC3
InChI=1SC14H16N2O3S2c131613(18)1185469(8)2112(11)1514(16)20710(17)192h37H212H3
methyl((3ethyl4oxo3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin2yl)sulfanyl)acetate
methyl2((2ethyl1oxo78dihydro6Hcyclopenta(23)thieno(24b)pyrimidin3yl)sulfanyl)acetate
methyl2((3ethyl4oxo4567tetrahydro3Hcyclopenta(45)thieno(23d)pyrimidin2yl)thio)acetate
MFCD01470973
STK007354
ZINC000000432773
ZINC00432773
ZINC432773

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Available files

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