Vitas-M small molecule compound
6-(4-bromo-2-fluorobenzyl)-3-ethyl-5-methyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Catalog ID
STK613097
SMILES CCn1c(=S)sc2c1nc(C)n(c2=O)Cc1ccc(cc1F)Br
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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 C15H13BrFN3OS2 MW 414.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13BrFN3OS2/c1-3-19-13-12(23-15(19)22)14(21)20(8(2)18-13)7-9-4-5-10(16)6-11(9)17/h4-6H,3,7H2,1-2H3InChIKey
CPAYBWCOZDMTCE-UHFFFAOYSA-NSynonyms
903861-91-66((4bromo2fluorophenyl)methyl)3ethyl5methyl2sulfanylidene(13)thiazolo(45d)pyrimidin7one
6(4bromo2fluorobenzyl)3ethyl5methyl2thioxo23dihydro(13)thiazolo(45d)pyrimidin7(6H)one
6(4bromo2fluorobenzyl)3ethyl5methyl2thioxo23dihydrothiazolo(45d)pyrimidin7(6H)one
903861916
CCN1C2=C(C(=O)N(C(=N2)C)CC3=C(C=C(C=C3)Br)F)SC1=S
InChI=1SC15H13BrFN3OS2c13191312(2315(19)22)14(21)20(8(2)1813)794510(16)611(9)17h46H37H212H3
MFCD08291359
ZINC000009435306
ZINC09435306
ZINC9435306
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