Vitas-M small molecule compound
2-[4-(5-acetyl-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidin-4-yl)-2-bromo-6-methoxyphenoxy]acetamide
Catalog ID
STL175715
SMILES COc1cc(cc(c1OCC(=O)N)Br)C1NC(=S)NC(=C1C(=O)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 C16H18BrN3O4S MW 428.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18BrN3O4S/c1-7-13(8(2)21)14(20-16(25)19-7)9-4-10(17)15(11(5-9)23-3)24-6-12(18)22/h4-5,14H,6H2,1-3H3,(H2,18,22)(H2,19,20,25)InChIKey
LCEAGEUGAVSMKV-UHFFFAOYSA-NSynonyms
2(4(5acetyl6methyl2sulfanylidene34dihydro1Hpyrimidin4yl)2bromo6methoxyphenoxy)acetamide
2(4(5acetyl6methyl2thioxo1234tetrahydropyrimidin4yl)2bromo6methoxyphenoxy)acetamide
CC1=C(C(NC(=S)N1)C2=CC(=C(C(=C2)Br)OCC(=O)N)OC)C(=O)C
InChI=1SC16H18BrN3O4Sc1713(8(2)21)14(2016(25)197)9410(17)15(11(59)233)24612(18)22h4514H6H213H3(H21822)(H2192025)
MFCD03073359
ZINC000013914767
ZINC000013914768
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