Vitas-M small molecule compound
(5Z)-5-[3-ethoxy-4-(prop-2-yn-1-yloxy)benzylidene]-1-methyl-3-phenyl-2-thioxoimidazolidin-4-one
Catalog ID
STL369539
SMILES CCOc1cc(ccc1OCC#C)/C=C/1\N(C)C(=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 C22H20N2O3S MW 392.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O3S/c1-4-13-27-19-12-11-16(15-20(19)26-5-2)14-18-21(25)24(22(28)23(18)3)17-9-7-6-8-10-17/h1,6-12,14-15H,5,13H2,2-3H3/b18-14-InChIKey
CBJHHGBOGUBMSV-JXAWBTAJSA-NSynonyms
(5Z)5((3ETHOXY4PROP2YNOXYPHENYL)METHYLIDENE)1METHYL3PHENYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(3ethoxy4(prop2yn1yloxy)benzylidene)1methyl3phenyl2thioxoimidazolidin4one
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)N2C)C3=CC=CC=C3)OCC#C
CCOc1cc(ccc1OCC#C)C=C1N(C)C(=S)N(C1=O)c1ccccc1
InChI=1SC22H20N2O3Sc14132719121116(1520(19)2652)141821(25)24(22(28)23(18)3)1797681017h16121415H513H223H3b1814
MFCD03697219
ZINC000006387884
ZINC06387884
ZINC6387884
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