Vitas-M small molecule compound
(5Z)-5-[3-ethoxy-5-iodo-4-(naphthalen-1-ylmethoxy)benzylidene]-3-ethyl-2-thioxoimidazolidin-4-one
Catalog ID
STL376530
SMILES CCOc1cc(/C=C/2\NC(=S)N(C2=O)CC)cc(c1OCc1cccc2c1cccc2)I
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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 C25H23IN2O3S MW 558.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23IN2O3S/c1-3-28-24(29)21(27-25(28)32)13-16-12-20(26)23(22(14-16)30-4-2)31-15-18-10-7-9-17-8-5-6-11-19(17)18/h5-14H,3-4,15H2,1-2H3,(H,27,32)/b21-13-InChIKey
YTRBVKDHDKDSTH-BKUYFWCQSA-NSynonyms
(5Z)5((3ETHOXY5IODO4(NAPHTHALEN1YLMETHOXY)PHENYL)METHYLIDENE)3ETHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(3ethoxy5iodo4(naphthalen1ylmethoxy)benzylidene)3ethyl2thioxoimidazolidin4one
CCN1C(=O)C(=CC2=CC(=C(C(=C2)I)OCC3=CC=CC4=CC=CC=C43)OCC)NC1=S
CCOc1cc(C=C2NC(=S)N(C2=O)CC)cc(c1OCc1cccc2c1cccc2)I
InChI=1SC25H23IN2O3Sc132824(29)21(2725(28)32)13161220(26)23(22(1416)3042)3115181079178561119(17)18h514H3415H212H3(H2732)b2113
MFCD07435813
ZINC000100274792
ZINC100274792
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