Vitas-M small molecule compound
2-[(6-amino-4-oxo-1,4-dihydropyrimidin-2-yl)sulfanyl]-N-(3,4,5-tribromo-2-methoxyphenyl)acetamide
Catalog ID
STK216017
SMILES COc1c(NC(=O)CSc2[nH]c(N)cc(=O)n2)cc(c(c1Br)Br)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 C13H11Br3N4O3S MW 543.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11Br3N4O3S/c1-23-12-6(2-5(14)10(15)11(12)16)18-9(22)4-24-13-19-7(17)3-8(21)20-13/h2-3H,4H2,1H3,(H,18,22)(H3,17,19,20,21)InChIKey
CPBBYEWWOXTYRJ-UHFFFAOYSA-NSynonyms
2((6AMINO4OXO14DIHYDROPYRIMIDIN2YL)SULFANYL)N(345TRIBROMO2METHOXYPHENYL)ACETAMIDE
2((6AMINO4OXO1HPYRIMIDIN2YL)SULFANYL)N(345TRIBROMO2METHOXYPHENYL)ACETAMIDE
COC1=C(C(=C(C=C1NC(=O)CSC2=NC(=O)C=C(N2)N)Br)Br)Br
COc1c(NC(=O)CSc2(nH)c(N)cc(=O)n2)cc(c(c1Br)Br)Br
InChI=1SC13H11Br3N4O3Sc123126(25(14)10(15)11(12)16)189(22)42413197(17)38(21)2013h23H4H21H3(H1822)(H317192021)
MFCD02873586
ZINC000097995366
ZINC97995366
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