Vitas-M small molecule compound
2-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL340024
SMILES C=CCn1c(SC/C=C/c2ccccc2)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 C22H22N2OS2 MW 394.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2OS2/c1-2-14-24-21(25)19-17-12-6-7-13-18(17)27-20(19)23-22(24)26-15-8-11-16-9-4-3-5-10-16/h2-5,8-11H,1,6-7,12-15H2/b11-8+InChIKey
AVTCPAOLXVCBTJ-DHZHZOJOSA-NSynonyms
468079-62-12(((2E)3phenylprop2en1yl)sulfanyl)3(prop2en1yl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((E)3phenylprop2enyl)sulfanyl3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
3allyl2(cinnamylthio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
468079621
C=CCN1C(=O)C2=C(N=C1SCC=CC3=CC=CC=C3)SC4=C2CCCC4
C=CCn1c(SCC=Cc2ccccc2)nc2c(c1=O)c1CCCCc1s2
InChI=1SC22H22N2OS2c12142421(25)191712671318(17)2720(19)2322(24)26158111694351016h25811H1671215H2b118+
MFCD02970136
ZINC000002447988
ZINC02447988
ZINC2447988
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