Vitas-M small molecule compound
5-{3-bromo-4-[(2-fluorobenzyl)oxy]-5-methoxybenzylidene}-1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK187988
SMILES COc1cc(C=C2C(=O)N(C)C(=S)N(C2=O)C)cc(c1OCc1ccccc1F)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 C21H18BrFN2O4S MW 493.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrFN2O4S/c1-24-19(26)14(20(27)25(2)21(24)30)8-12-9-15(22)18(17(10-12)28-3)29-11-13-6-4-5-7-16(13)23/h4-10H,11H2,1-3H3InChIKey
GBDDCQTZBBEDCK-UHFFFAOYSA-NSynonyms
6315-24-85((3BROMO4((2FLUOROPHENYL)METHOXY)5METHOXYPHENYL)METHYLENE)13DIMETHYL2THIOXO13DIHYDROPYRIMIDINE46DIONE
5((3BROMO4((2FLUOROPHENYL)METHOXY)5METHOXYPHENYL)METHYLIDENE)13DIMETHYL2SULFANYLIDENE13DIAZINANE46DIONE
5(3BROMO4((2FLUOROBENZYL)OXY)5METHOXYBENZYLIDENE)13DIMETHYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
6315248
CN1C(=O)C(=CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3F)OC)C(=O)N(C1=S)C
InChI=1SC21H18BrFN2O4Sc12419(26)14(20(27)25(2)21(24)30)812915(22)18(17(1012)283)291113645716(13)23h410H11H213H3
MFCD02779664
ZINC000001185960
ZINC01185960
ZINC1185960
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