Vitas-M small molecule compound
(5Z)-3-cyclohexyl-5-[3-ethoxy-4-(prop-2-yn-1-yloxy)benzylidene]-2-thioxoimidazolidin-4-one
Catalog ID
STL375331
SMILES CCOc1cc(ccc1OCC#C)/C=C/1\NC(=S)N(C1=O)C1CCCCC1
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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 C21H24N2O3S MW 384.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O3S/c1-3-12-26-18-11-10-15(14-19(18)25-4-2)13-17-20(24)23(21(27)22-17)16-8-6-5-7-9-16/h1,10-11,13-14,16H,4-9,12H2,2H3,(H,22,27)/b17-13-InChIKey
GNKXNENPLAFTQY-LGMDPLHJSA-NSynonyms
(5Z)3CYCLOHEXYL5((3ETHOXY4PROP2YNOXYPHENYL)METHYLIDENE)2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)3cyclohexyl5(3ethoxy4(prop2yn1yloxy)benzylidene)2thioxoimidazolidin4one
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)N2)C3CCCCC3)OCC#C
CCOc1cc(ccc1OCC#C)C=C1NC(=S)N(C1=O)C1CCCCC1
InChI=1SC21H24N2O3Sc13122618111015(1419(18)2542)131720(24)23(21(27)2217)168657916h11011131416H4912H22H3(H2227)b1713
MFCD04086973
ZINC000003667769
ZINC03667769
ZINC3667769
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