Vitas-M small molecule compound
6-(4-methoxyphenyl)-1-(2-methylprop-2-en-1-yl)-3-(methylsulfanyl)thieno[2,3-d][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Catalog ID
STK943276
SMILES CSc1nn(c2n1c(=O)c1c(n2)scc1c1ccc(cc1)OC)CC(=C)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 C19H18N4O2S2 MW 398.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O2S2/c1-11(2)9-22-18-20-16-15(17(24)23(18)19(21-22)26-4)14(10-27-16)12-5-7-13(25-3)8-6-12/h5-8,10H,1,9H2,2-4H3InChIKey
KXMBYFYZAJRHLM-UHFFFAOYSA-NSynonyms
1219562-33-01219562330
6(4methoxyphenyl)1(2methylallyl)3(methylthio)thieno(23d)(124)triazolo(43a)pyrimidin5(1H)one
6(4methoxyphenyl)1(2methylprop2en1yl)3(methylsulfanyl)thieno(23d)(124)triazolo(43a)pyrimidin5(1H)one
CC(=C)CN1C2=NC3=C(C(=CS3)C4=CC=C(C=C4)OC)C(=O)N2C(=N1)SC
InChI=1SC19H18N4O2S2c111(2)92218201615(17(24)23(18)19(2122)264)14(102716)125713(253)8612h5810H19H224H3
MFCD16627304
ZINC000040287748
ZINC40287748
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