Vitas-M small molecule compound
3-(2-methylprop-2-en-1-yl)-2-(prop-2-en-1-ylsulfanyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK993879
SMILES C=CCSc1nc2sc3c(c2c(=O)n1CC(=C)C)CCCCC3
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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 C18H22N2OS2 MW 346.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2OS2/c1-4-10-22-18-19-16-15(17(21)20(18)11-12(2)3)13-8-6-5-7-9-14(13)23-16/h4H,1-2,5-11H2,3H3InChIKey
UQLXPDNKPKTCTP-UHFFFAOYSA-NSynonyms
3(2methylprop2en1yl)2(prop2en1ylsulfanyl)356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
3(2methylprop2enyl)2prop2enylsulfanyl6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
CC(=C)CN1C(=O)C2=C(N=C1SCC=C)SC3=C2CCCCC3
InChI=1SC18H22N2OS2c14102218191615(17(21)20(18)1112(2)3)138657914(13)2316h4H12511H23H3
MFCD02631032
ZINC000002895494
ZINC02895494
ZINC2895494
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