Vitas-M small molecule compound
2-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-6,8-dioxabicyclo[3.2.1]octan-4-one (non-preferred name)
Catalog ID
STK341891
SMILES COc1cc(ccc1OC)c1nc(SC2CC(=O)C3OC2CO3)nc(c1)C(F)(F)F
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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 C19H17F3N2O5S MW 442.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17F3N2O5S/c1-26-12-4-3-9(5-13(12)27-2)10-6-16(19(20,21)22)24-18(23-10)30-15-7-11(25)17-28-8-14(15)29-17/h3-6,14-15,17H,7-8H2,1-2H3InChIKey
VIGGFYOEGXMIPM-UHFFFAOYSA-NSynonyms
1093647-09-61093647096
2((4(34dimethoxyphenyl)6(trifluoromethyl)pyrimidin2yl)sulfanyl)68dioxabicyclo(321)octan4one(nonpreferredname)
2(4(34DIMETHOXYPHENYL)6(TRIFLUOROMETHYL)PYRIMIDIN2YL)SULFANYL68DIOXABICYCLO(321)OCTAN4ONE
COC1=C(C=C(C=C1)C2=CC(=NC(=N2)SC3CC(=O)C4OCC3O4)C(F)(F)F)OC
InChI=1SC19H17F3N2O5Sc12612439(513(12)272)10616(19(2021)22)2418(2310)3015711(25)1728814(15)2917h36141517H78H212H3
MFCD03034898
ZINC000102998775
ZINC000102998777
Check stock
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Check stock on Vitas-MAvailable files
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