Vitas-M small molecule compound
(5Z)-5-(3-bromo-4,5-diethoxybenzylidene)-3-cyclohexyl-2-thioxoimidazolidin-4-one
Catalog ID
STK104327
SMILES CCOc1cc(/C=C/2\NC(=S)N(C2=O)C2CCCCC2)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 C20H25BrN2O3S MW 453.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25BrN2O3S/c1-3-25-17-12-13(10-15(21)18(17)26-4-2)11-16-19(24)23(20(27)22-16)14-8-6-5-7-9-14/h10-12,14H,3-9H2,1-2H3,(H,22,27)/b16-11-InChIKey
HLSMMZAHCUCMHB-WJDWOHSUSA-NSynonyms
(5Z)5((3BROMO45DIETHOXYPHENYL)METHYLIDENE)3CYCLOHEXYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(3BROMO45DIETHOXYBENZYLIDENE)3CYCLOHEXYL2THIOXOIMIDAZOLIDIN4ONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)N2)C3CCCCC3)Br)OCC
CCOc1cc(C=C2NC(=S)N(C2=O)C2CCCCC2)cc(c1OCC)Br
InChI=1SC20H25BrN2O3Sc1325171213(1015(21)18(17)2642)111619(24)23(20(27)2216)148657914h101214H39H212H3(H2227)b1611
MFCD04086932
ZINC000003667797
ZINC03667797
ZINC3667797
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