Vitas-M small molecule compound
5-methyl-3-(4-methylphenyl)-2-(prop-2-en-1-ylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK722290
SMILES C=CCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)C(C)CCC3
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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 C21H22N2OS2 MW 382.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2OS2/c1-4-12-25-21-22-19-18(17-14(3)6-5-7-16(17)26-19)20(24)23(21)15-10-8-13(2)9-11-15/h4,8-11,14H,1,5-7,12H2,2-3H3InChIKey
UYQLDZZEWSIYJA-UHFFFAOYSA-NSynonyms
2(allylthio)5methyl3(ptolyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
5methyl3(4methylphenyl)2(prop2en1ylsulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
5methyl3(4methylphenyl)2prop2enylsulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1CCCC2=C1C3=C(S2)N=C(N(C3=O)C4=CC=C(C=C4)C)SCC=C
InChI=1SC21H22N2OS2c14122521221918(1714(3)65716(17)2619)20(24)23(21)1510813(2)91115h481114H15712H223H3
MFCD02994480
ZINC000002302103
ZINC000002302104
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