Vitas-M small molecule compound
(5Z)-5-{4-[(4-bromobenzyl)oxy]-3-ethoxybenzylidene}-3-propyl-2-thioxoimidazolidin-4-one
Catalog ID
STL375311
SMILES CCCN1C(=S)N/C(=C\c2ccc(c(c2)OCC)OCc2ccc(cc2)Br)/C1=O
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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 C22H23BrN2O3S MW 475.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrN2O3S/c1-3-11-25-21(26)18(24-22(25)29)12-16-7-10-19(20(13-16)27-4-2)28-14-15-5-8-17(23)9-6-15/h5-10,12-13H,3-4,11,14H2,1-2H3,(H,24,29)/b18-12-InChIKey
GKTOKQWDPBVYFM-PDGQHHTCSA-NSynonyms
(5Z)5((4((4BROMOPHENYL)METHOXY)3ETHOXYPHENYL)METHYLIDENE)3PROPYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(4((4bromobenzyl)oxy)3ethoxybenzylidene)3propyl2thioxoimidazolidin4one
CCCN1C(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)Br)OCC)NC1=S
CCCN1C(=S)NC(=Cc2ccc(c(c2)OCC)OCc2ccc(cc2)Br)C1=O
InChI=1SC22H23BrN2O3Sc13112521(26)18(2422(25)29)121671019(20(1316)2742)2814155817(23)9615h5101213H341114H212H3(H2429)b1812
MFCD04086881
ZINC000003667727
ZINC03667727
ZINC3667727
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