Vitas-M small molecule compound
(5Z)-5-[4-(benzyloxy)-3-ethoxybenzylidene]-3-cyclohexyl-2-thioxoimidazolidin-4-one
Catalog ID
STL375259
SMILES CCOc1cc(ccc1OCc1ccccc1)/C=C/1\NC(=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 C25H28N2O3S MW 436.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O3S/c1-2-29-23-16-19(13-14-22(23)30-17-18-9-5-3-6-10-18)15-21-24(28)27(25(31)26-21)20-11-7-4-8-12-20/h3,5-6,9-10,13-16,20H,2,4,7-8,11-12,17H2,1H3,(H,26,31)/b21-15-InChIKey
YAFAWYDHWFQVFE-QNGOZBTKSA-NSynonyms
(5Z)3CYCLOHEXYL5((3ETHOXY4PHENYLMETHOXYPHENYL)METHYLIDENE)2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(4(benzyloxy)3ethoxybenzylidene)3cyclohexyl2thioxoimidazolidin4one
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)N2)C3CCCCC3)OCC4=CC=CC=C4
CCOc1cc(ccc1OCc1ccccc1)C=C1NC(=S)N(C1=O)C1CCCCC1
InChI=1SC25H28N2O3Sc1229231619(131422(23)30171895361018)152124(28)27(25(31)2621)20117481220h356910131620H2478111217H21H3(H2631)b2115
MFCD04086960
ZINC000003667619
ZINC03667619
ZINC3667619
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