Vitas-M small molecule compound
3-(prop-2-en-1-yl)-2-{[3-(trifluoromethyl)benzyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL340706
SMILES C=CCn1c(SCc2cccc(c2)C(F)(F)F)nc2c(c1=O)c1CCCCc1s2
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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 C21H19F3N2OS2 MW 436.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19F3N2OS2/c1-2-10-26-19(27)17-15-8-3-4-9-16(15)29-18(17)25-20(26)28-12-13-6-5-7-14(11-13)21(22,23)24/h2,5-7,11H,1,3-4,8-10,12H2InChIKey
WFNWRFGXSIQSNH-UHFFFAOYSA-NSynonyms
561059-88-93(prop2en1yl)2((3(trifluoromethyl)benzyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3allyl2((3(trifluoromethyl)benzyl)thio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3prop2enyl2((3(trifluoromethyl)phenyl)methylsulfanyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
561059889
C=CCN1C(=O)C2=C(N=C1SCC3=CC(=CC=C3)C(F)(F)F)SC4=C2CCCC4
InChI=1SC21H19F3N2OS2c12102619(27)1715834916(15)2918(17)2520(26)28121365714(1113)21(2223)24h25711H13481012H2
MFCD04021760
ZINC000002336173
ZINC02336173
ZINC2336173
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