Vitas-M small molecule compound
(5Z)-5-[5-bromo-2-(prop-2-yn-1-yloxy)benzylidene]-3-cyclohexyl-1-methyl-2-thioxoimidazolidin-4-one
Catalog ID
STL375293
SMILES CN1C(=S)N(C(=O)/C/1=C/c1cc(Br)ccc1OCC#C)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 C20H21BrN2O2S MW 433.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN2O2S/c1-3-11-25-18-10-9-15(21)12-14(18)13-17-19(24)23(20(26)22(17)2)16-7-5-4-6-8-16/h1,9-10,12-13,16H,4-8,11H2,2H3/b17-13-InChIKey
HDSIVZFKRRPLQG-LGMDPLHJSA-NSynonyms
(5Z)5((5BROMO2PROP2YNOXYPHENYL)METHYLIDENE)3CYCLOHEXYL1METHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(5bromo2(prop2yn1yloxy)benzylidene)3cyclohexyl1methyl2thioxoimidazolidin4one
CN1C(=CC2=C(C=CC(=C2)Br)OCC#C)C(=O)N(C1=S)C3CCCCC3
CN1C(=S)N(C(=O)C1=Cc1cc(Br)ccc1OCC#C)C1CCCCC1
InChI=1SC20H21BrN2O2Sc1311251810915(21)1214(18)131719(24)23(20(26)22(17)2)167546816h1910121316H4811H22H3b1713
MFCD04062563
ZINC000009296155
ZINC09296155
ZINC9296155
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