Vitas-M small molecule compound
3-butyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK996256
SMILES CCCCn1c(SCC(=O)c2ccccc2)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 C21H22N2O2S2 MW 398.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O2S2/c1-2-3-12-23-20(25)18-15-10-7-11-17(15)27-19(18)22-21(23)26-13-16(24)14-8-5-4-6-9-14/h4-6,8-9H,2-3,7,10-13H2,1H3InChIKey
FFUMWSDMCXPEAJ-UHFFFAOYSA-NSynonyms
2butyl3phenacylsulfanyl78dihydro6Hcyclopenta(23)thieno(24b)pyrimidin1one
3butyl2((2oxo2phenylethyl)sulfanyl)3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin4one
CCCCN1C(=O)C2=C(N=C1SCC(=O)C3=CC=CC=C3)SC4=C2CCC4
InChI=1SC21H22N2O2S2c123122320(25)18151071117(15)2719(18)2221(23)261316(24)148546914h4689H2371013H21H3
MFCD02631078
ZINC000002910651
ZINC02910651
ZINC2910651
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