Vitas-M small molecule compound
2-(3,5-dibromo-2-methoxyphenyl)-7-(2-methylbutan-2-yl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Catalog ID
STK383120
SMILES COc1c(Br)cc(cc1C1N=C(O)c2c(N1)sc1c2CCC(C1)C(CC)(C)C)Br
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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 C22H26Br2N2O2S MW 542.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26Br2N2O2S/c1-5-22(2,3)11-6-7-13-16(8-11)29-21-17(13)20(27)25-19(26-21)14-9-12(23)10-15(24)18(14)28-4/h9-11,19,26H,5-8H2,1-4H3,(H,25,27)InChIKey
QVNURQVZUOVXSL-UHFFFAOYSA-NSynonyms
2(35dibromo2methoxyphenyl)7(2methylbutan2yl)125678hexahydro(1)benzothieno(23d)pyrimidin4ol
2(35dibromo2methoxyphenyl)7(2methylbutan2yl)235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
CCC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC(=CC(=C4OC)Br)Br
InChI=1SC22H26Br2N2O2Sc1522(23)11671316(811)292117(13)20(27)2519(2621)14912(23)1015(24)18(14)284h9111926H58H214H3(H2527)
MFCD03103362
ZINC000102087604
ZINC000102087614
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