Vitas-M small molecule compound
(5Z)-5-[3-bromo-5-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]-3-(4-ethoxyphenyl)-2-thioxoimidazolidin-4-one
Catalog ID
STL368991
SMILES C#CCOc1c(Br)cc(cc1OC)/C=C/1\NC(=S)N(C1=O)c1ccc(cc1)OCC
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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 C22H19BrN2O4S MW 487.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19BrN2O4S/c1-4-10-29-20-17(23)11-14(13-19(20)27-3)12-18-21(26)25(22(30)24-18)15-6-8-16(9-7-15)28-5-2/h1,6-9,11-13H,5,10H2,2-3H3,(H,24,30)/b18-12-InChIKey
QCXIQQPJLCWLFW-PDGQHHTCSA-NSynonyms
(5Z)5((3BROMO5METHOXY4PROP2YNOXYPHENYL)METHYLIDENE)3(4ETHOXYPHENYL)2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(3bromo5methoxy4(prop2yn1yloxy)benzylidene)3(4ethoxyphenyl)2thioxoimidazolidin4one
5(3BROMO5METHOXY4(2PROPYNYLOXY)BENZYLIDENE)3(4ETHOXYPHENYL)2THIOXO4IMIDAZOLIDINONE
C#CCOc1c(Br)cc(cc1OC)C=C1NC(=S)N(C1=O)c1ccc(cc1)OCC
CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Br)OCC#C)OC)NC2=S
InChI=1SC22H19BrN2O4Sc1410292017(23)1114(1319(20)273)121821(26)25(22(30)2418)156816(9715)2852h1691113H510H223H3(H2430)b1812
MFCD03082538
ZINC000008438965
ZINC08438965
ZINC8438965
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