Vitas-M small molecule compound
2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL334722
SMILES C=CCn1c(SCC(=O)c2ccc(cc2)C)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 C22H22N2O2S2 MW 410.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O2S2/c1-3-12-24-21(26)19-16-6-4-5-7-18(16)28-20(19)23-22(24)27-13-17(25)15-10-8-14(2)9-11-15/h3,8-11H,1,4-7,12-13H2,2H3InChIKey
VALYLIBRIOLDNK-UHFFFAOYSA-NSynonyms
421577-83-52((2(4methylphenyl)2oxoethyl)sulfanyl)3(prop2en1yl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(2(4methylphenyl)2oxoethyl)sulfanyl3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
3allyl2((2oxo2(ptolyl)ethyl)thio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
421577835
CC1=CC=C(C=C1)C(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2CC=C
InChI=1SC22H22N2O2S2c13122421(26)1916645718(16)2820(19)2322(24)271317(25)1510814(2)91115h3811H1471213H22H3
MFCD02924614
ZINC000000641519
ZINC00641519
ZINC641519
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