Vitas-M small molecule compound
(5Z)-5-[3-ethoxy-4-(prop-2-yn-1-yloxy)benzylidene]-3-ethyl-2-thioxoimidazolidin-4-one
Catalog ID
STL378733
SMILES CCOc1cc(ccc1OCC#C)/C=C/1\NC(=S)N(C1=O)CC
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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 C17H18N2O3S MW 330.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O3S/c1-4-9-22-14-8-7-12(11-15(14)21-6-3)10-13-16(20)19(5-2)17(23)18-13/h1,7-8,10-11H,5-6,9H2,2-3H3,(H,18,23)/b13-10-InChIKey
GKTCGWALVRAMOA-RAXLEYEMSA-NSynonyms
(5Z)5((3ETHOXY4PROP2YNOXYPHENYL)METHYLIDENE)3ETHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(3ethoxy4(prop2yn1yloxy)benzylidene)3ethyl2thioxoimidazolidin4one
CCN1C(=O)C(=CC2=CC(=C(C=C2)OCC#C)OCC)NC1=S
CCOc1cc(ccc1OCC#C)C=C1NC(=S)N(C1=O)CC
InChI=1SC17H18N2O3Sc14922148712(1115(14)2163)101316(20)19(52)17(23)1813h1781011H569H223H3(H1823)b1310
MFCD03711548
ZINC000003464435
ZINC03464435
ZINC3464435
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