Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-2-{[2-(4-fluorophenoxy)ethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL143397
SMILES Fc1ccc(cc1)OCCSc1nc2ccsc2c(=O)n1Cc1ccc2c(c1)OCO2
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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 C22H17FN2O4S2 MW 456.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17FN2O4S2/c23-15-2-4-16(5-3-15)27-8-10-31-22-24-17-7-9-30-20(17)21(26)25(22)12-14-1-6-18-19(11-14)29-13-28-18/h1-7,9,11H,8,10,12-13H2InChIKey
QNWUCQRGRZKOOB-UHFFFAOYSA-NSynonyms
3(13benzodioxol5ylmethyl)2((2(4fluorophenoxy)ethyl)sulfanyl)thieno(32d)pyrimidin4(3H)one
3(13benzodioxol5ylmethyl)2(2(4fluorophenoxy)ethylsulfanyl)thieno(32d)pyrimidin4one
C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=C(C=CS4)N=C3SCCOC5=CC=C(C=C5)F
InChI=1SC22H17FN2O4S2c23152416(5315)2781031222417793020(17)21(26)25(22)1214161819(1114)29132818h17911H8101213H2
MFCD20749191
ZINC000071327603
ZINC71327603
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