Vitas-M small molecule compound
(5Z)-5-(5-bromo-2,4-diethoxybenzylidene)-3-cyclohexyl-1-methyl-2-thioxoimidazolidin-4-one
Catalog ID
STL417284
SMILES CCOc1cc(OCC)c(cc1/C=C\1/C(=O)N(C(=S)N1C)C1CCCCC1)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 C21H27BrN2O3S MW 467.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27BrN2O3S/c1-4-26-18-13-19(27-5-2)16(22)11-14(18)12-17-20(25)24(21(28)23(17)3)15-9-7-6-8-10-15/h11-13,15H,4-10H2,1-3H3/b17-12-InChIKey
JPDLHPAUQUSGEO-ATVHPVEESA-NSynonyms
(5Z)5((5BROMO24DIETHOXYPHENYL)METHYLIDENE)3CYCLOHEXYL1METHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(5bromo24diethoxybenzylidene)3cyclohexyl1methyl2thioxoimidazolidin4one
CCOC1=CC(=C(C=C1C=C2C(=O)N(C(=S)N2C)C3CCCCC3)Br)OCC
CCOc1cc(OCC)c(cc1C=C1C(=O)N(C(=S)N1C)C1CCCCC1)Br
InChI=1SC21H27BrN2O3Sc1426181319(2752)16(22)1114(18)121720(25)24(21(28)23(17)3)1597681015h111315H410H213H3b1712
MFCD04062531
ZINC000003662856
ZINC03662856
ZINC3662856
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