Vitas-M small molecule compound
(5E)-1-(1,3-benzodioxol-5-yl)-5-[(5-bromo-1H-indol-3-yl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK175298
SMILES Brc1ccc2c(c1)c(c[nH]2)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc2c(c1)OCO2
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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 C20H12BrN3O5 MW 454.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12BrN3O5/c21-11-1-3-15-13(6-11)10(8-22-15)5-14-18(25)23-20(27)24(19(14)26)12-2-4-16-17(7-12)29-9-28-16/h1-8,22H,9H2,(H,23,25,27)/b14-5+InChIKey
ILXXLVPRRICFPQ-LHHJGKSTSA-NSynonyms
(5E)1(13benzodioxol5yl)5((5bromo1Hindol3yl)methylidene)13diazinane246trione
(5E)1(13BENZODIOXOL5YL)5((5BROMO1HINDOL3YL)METHYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
Brc1ccc2c(c1)c(c(nH)2)C=C1C(=O)NC(=O)N(C1=O)c1ccc2c(c1)OCO2
C1OC2=C(O1)C=C(C=C2)N3C(=O)C(=CC4=CNC5=C4C=C(C=C5)Br)C(=O)NC3=O
InChI=1SC20H12BrN3O5c2111131513(611)10(82215)51418(25)2320(27)24(19(14)26)12241617(712)2992816h1822H9H2(H232527)b145+
MFCD05025243
ZINC000009892469
ZINC09892469
ZINC9892469
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