Vitas-M small molecule compound
2-{[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]sulfanyl}-3-ethyl-6-methylthieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL178966
SMILES CCn1c(SCC(=O)c2ccc3c(c2)OCCO3)nc2c(c1=O)cc(s2)C
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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 C19H18N2O4S2 MW 402.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O4S2/c1-3-21-18(23)13-8-11(2)27-17(13)20-19(21)26-10-14(22)12-4-5-15-16(9-12)25-7-6-24-15/h4-5,8-9H,3,6-7,10H2,1-2H3InChIKey
KHMCBJAZAYOALC-UHFFFAOYSA-NSynonyms
938005-56-22((2(23dihydro14benzodioxin6yl)2oxoethyl)sulfanyl)3ethyl6methylthieno(23d)pyrimidin4(3H)one
2(2(23dihydro14benzodioxin6yl)2oxoethyl)sulfanyl3ethyl6methylthieno(23d)pyrimidin4one
938005562
CCN1C(=O)C2=C(N=C1SCC(=O)C3=CC4=C(C=C3)OCCO4)SC(=C2)C
InChI=1SC19H18N2O4S2c132118(23)13811(2)2717(13)2019(21)261014(22)12451516(912)25762415h4589H36710H212H3
MFCD08556661
ZINC000036615162
ZINC36615162
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