Vitas-M small molecule compound
5-[4-(benzyloxy)-3-bromo-5-ethoxybenzylidene]-1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK188160
SMILES CCOc1cc(C=C2C(=O)N(C)C(=S)N(C2=O)C)cc(c1OCc1ccccc1)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 C22H21BrN2O4S MW 489.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21BrN2O4S/c1-4-28-18-12-15(10-16-20(26)24(2)22(30)25(3)21(16)27)11-17(23)19(18)29-13-14-8-6-5-7-9-14/h5-12H,4,13H2,1-3H3InChIKey
RQQYNEBAEOZXAS-UHFFFAOYSA-NSynonyms
5((3BROMO5ETHOXY4PHENYLMETHOXYPHENYL)METHYLIDENE)13DIMETHYL2SULFANYLIDENE13DIAZINANE46DIONE
5(4(BENZYLOXY)3BROMO5ETHOXYBENZYLIDENE)13DIMETHYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)N(C2=O)C)C)Br)OCC3=CC=CC=C3
InChI=1SC22H21BrN2O4Sc1428181215(101620(26)24(2)22(30)25(3)21(16)27)1117(23)19(18)2913148657914h512H413H213H3
MFCD02624210
ZINC000001176771
ZINC01176771
ZINC1176771
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