Vitas-M small molecule compound
3-(prop-2-en-1-yl)-2-(prop-2-yn-1-ylsulfanyl)-1,2,3,5,6,7-hexahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STL012027
SMILES C=CCN1C(SCC#C)Nc2c(C1=O)c1CCCc1s2
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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 C15H16N2OS2 MW 304.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N2OS2/c1-3-8-17-14(18)12-10-6-5-7-11(10)20-13(12)16-15(17)19-9-4-2/h2-3,15-16H,1,5-9H2InChIKey
IEPKXGFLUPAFBC-UHFFFAOYSA-NSynonyms
2prop2enyl3prop2ynylsulfanyl4678tetrahydro3Hcyclopenta(23)thieno(24d)pyrimidin1one
3(prop2en1yl)2(prop2yn1ylsulfanyl)123567hexahydro4Hcyclopenta(45)thieno(23d)pyrimidin4one
C=CCN1C(NC2=C(C1=O)C3=C(S2)CCC3)SCC#C
InChI=1SC15H16N2OS2c1381714(18)121065711(10)2013(12)1615(17)19942h231516H159H2
MFCD18074546
ZINC000051353967
ZINC000051353968
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