Vitas-M small molecule compound
2-{[2-(4-fluorophenoxy)ethyl]sulfanyl}-3-(3-methoxyphenyl)thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL143371
SMILES COc1cccc(c1)n1c(SCCOc2ccc(cc2)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 C21H17FN2O3S2 MW 428.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17FN2O3S2/c1-26-17-4-2-3-15(13-17)24-20(25)19-18(9-11-28-19)23-21(24)29-12-10-27-16-7-5-14(22)6-8-16/h2-9,11,13H,10,12H2,1H3InChIKey
ZNOPBGMESCEXTH-UHFFFAOYSA-NSynonyms
2((2(4fluorophenoxy)ethyl)sulfanyl)3(3methoxyphenyl)thieno(32d)pyrimidin4(3H)one
2(2(4fluorophenoxy)ethylsulfanyl)3(3methoxyphenyl)thieno(32d)pyrimidin4one
COC1=CC=CC(=C1)N2C(=O)C3=C(C=CS3)N=C2SCCOC4=CC=C(C=C4)F
InChI=1SC21H17FN2O3S2c1261742315(1317)2420(25)1918(9112819)2321(24)29121027167514(22)6816h291113H1012H21H3
MFCD20749160
ZINC000071327583
ZINC71327583
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