Vitas-M small molecule compound
1-[4-(2-bromo-4,5-dimethoxyphenyl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl]ethanone
Catalog ID
STL172733
SMILES COc1cc(c(cc1OC)Br)C1NC(=S)NC(=C1C(=O)C)c1ccccc1
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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 C20H19BrN2O3S MW 447.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrN2O3S/c1-11(24)17-18(12-7-5-4-6-8-12)22-20(27)23-19(17)13-9-15(25-2)16(26-3)10-14(13)21/h4-10,19H,1-3H3,(H2,22,23,27)InChIKey
BGVIGVDTTHOAER-UHFFFAOYSA-NSynonyms
515176-45-11(4(2BROMO45DIMETHOXYPHENYL)6PHENYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDIN5YL)ETHANONE
1(4(2bromo45dimethoxyphenyl)6phenyl2thioxo1234tetrahydropyrimidin5yl)ethanone
515176451
CC(=O)C1=C(NC(=S)NC1C2=CC(=C(C=C2Br)OC)OC)C3=CC=CC=C3
InChI=1SC20H19BrN2O3Sc111(24)1718(127546812)2220(27)2319(17)13915(252)16(263)1014(13)21h41019H13H3(H2222327)
MFCD03758566
ZINC000000696049
ZINC000000696050
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