Vitas-M small molecule compound
2-[(3-fluoro-4-methoxybenzyl)sulfanyl]-3-(4-methoxybenzyl)thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL166935
SMILES COc1ccc(cc1)Cn1c(SCc2ccc(c(c2)F)OC)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 C22H19FN2O3S2 MW 442.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19FN2O3S2/c1-27-16-6-3-14(4-7-16)12-25-21(26)20-18(9-10-29-20)24-22(25)30-13-15-5-8-19(28-2)17(23)11-15/h3-11H,12-13H2,1-2H3InChIKey
JMUPNHMERNLRHR-UHFFFAOYSA-NSynonyms
2((3fluoro4methoxybenzyl)sulfanyl)3(4methoxybenzyl)thieno(32d)pyrimidin4(3H)one
2((3fluoro4methoxyphenyl)methylsulfanyl)3((4methoxyphenyl)methyl)thieno(32d)pyrimidin4one
COC1=CC=C(C=C1)CN2C(=O)C3=C(C=CS3)N=C2SCC4=CC(=C(C=C4)OC)F
InChI=1SC22H19FN2O3S2c127166314(4716)122521(26)2018(9102920)2422(25)3013155819(282)17(23)1115h311H1213H212H3
MFCD20749232
ZINC000071768753
ZINC71768753
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