Vitas-M small molecule compound
3-(2-fluorobenzyl)-2-{[2-(trifluoromethyl)benzyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL125784
SMILES Fc1ccccc1Cn1c(SCc2ccccc2C(F)(F)F)nc2c(c1=O)scc2
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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 C21H14F4N2OS2 MW 450.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14F4N2OS2/c22-16-8-4-2-5-13(16)11-27-19(28)18-17(9-10-29-18)26-20(27)30-12-14-6-1-3-7-15(14)21(23,24)25/h1-10H,11-12H2InChIKey
NUCVYBBQLPLNDC-UHFFFAOYSA-NSynonyms
3((2fluorophenyl)methyl)2((2(trifluoromethyl)phenyl)methylsulfanyl)thieno(32d)pyrimidin4one
3(2fluorobenzyl)2((2(trifluoromethyl)benzyl)sulfanyl)thieno(32d)pyrimidin4(3H)one
C1=CC=C(C(=C1)CN2C(=O)C3=C(C=CS3)N=C2SCC4=CC=CC=C4C(F)(F)F)F
InChI=1SC21H14F4N2OS2c2216842513(16)112719(28)1817(9102918)2620(27)301214613715(14)21(2324)25h110H1112H2
MFCD20738213
ZINC000067259922
ZINC67259922
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