Vitas-M small molecule compound
(5Z)-3-cyclohexyl-5-{3-ethoxy-4-[(4-fluorobenzyl)oxy]benzylidene}-1-methyl-2-thioxoimidazolidin-4-one
Catalog ID
STL375239
SMILES CCOc1cc(ccc1OCc1ccc(cc1)F)/C=C/1\N(C)C(=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 C26H29FN2O3S MW 468.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29FN2O3S/c1-3-31-24-16-19(11-14-23(24)32-17-18-9-12-20(27)13-10-18)15-22-25(30)29(26(33)28(22)2)21-7-5-4-6-8-21/h9-16,21H,3-8,17H2,1-2H3/b22-15-InChIKey
CCAQXWSCPFCSBG-JCMHNJIXSA-NSynonyms
(5Z)3CYCLOHEXYL5((3ETHOXY4((4FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)1METHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)3cyclohexyl5(3ethoxy4((4fluorobenzyl)oxy)benzylidene)1methyl2thioxoimidazolidin4one
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)N2C)C3CCCCC3)OCC4=CC=C(C=C4)F
CCOc1cc(ccc1OCc1ccc(cc1)F)C=C1N(C)C(=S)N(C1=O)C1CCCCC1
InChI=1SC26H29FN2O3Sc1331241619(111423(24)32171891220(27)131018)152225(30)29(26(33)28(22)2)217546821h91621H3817H212H3b2215
MFCD04062544
ZINC000003662960
ZINC03662960
ZINC3662960
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