Vitas-M small molecule compound
(5E)-5-(3-bromo-4,5-diethoxybenzylidene)-3-ethyl-2-thioxoimidazolidin-4-one
Catalog ID
STL365535
SMILES CCOc1cc(/C=C\2/NC(=S)N(C2=O)CC)cc(c1OCC)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 C16H19BrN2O3S MW 399.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19BrN2O3S/c1-4-19-15(20)12(18-16(19)23)8-10-7-11(17)14(22-6-3)13(9-10)21-5-2/h7-9H,4-6H2,1-3H3,(H,18,23)/b12-8+InChIKey
WXERUNAWVYISFF-XYOKQWHBSA-NSynonyms
(5E)5((3bromo45diethoxyphenyl)methylidene)3ethyl2sulfanylideneimidazolidin4one
(5E)5(3bromo45diethoxybenzylidene)3ethyl2thioxoimidazolidin4one
CCN1C(=O)C(=CC2=CC(=C(C(=C2)Br)OCC)OCC)NC1=S
CCOc1cc(C=C2NC(=S)N(C2=O)CC)cc(c1OCC)Br
InChI=1SC16H19BrN2O3Sc141915(20)12(1816(19)23)810711(17)14(2263)13(910)2152h79H46H213H3(H1823)b128+
MFCD09476387
ZINC000015019169
ZINC15019169
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