Vitas-M small molecule compound
(5E,5'Z)-3,3'-hexane-1,6-diylbis{2-(2-methoxyphenyl)-5-[4-(propan-2-yloxy)benzylidene]-3,5-dihydro-4H-imidazol-4-one}
Catalog ID
STL441516
SMILES COc1ccccc1C1=N/C(=C/c2ccc(cc2)OC(C)C)/C(=O)N1CCCCCCN1C(=O)/C(=C/c2ccc(cc2)OC(C)C)/N=C1c1ccccc1OC
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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 C46H50N4O6 MW 754.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C46H50N4O6/c1-31(2)55-35-23-19-33(20-24-35)29-39-45(51)49(43(47-39)37-15-9-11-17-41(37)53-5)27-13-7-8-14-28-50-44(38-16-10-12-18-42(38)54-6)48-40(46(50)52)30-34-21-25-36(26-22-34)56-32(3)4/h9-12,15-26,29-32H,7-8,13-14,27-28H2,1-6H3/b39-29-,40-30+InChIKey
XHCGMSYFGWWQNK-IHQGOOSRSA-NSynonyms
(5E5Z)33hexane16diylbis(2(2methoxyphenyl)5(4(propan2yloxy)benzylidene)35dihydro4Himidazol4one)
(5Z)2(2METHOXYPHENYL)3(6((4E)2(2METHOXYPHENYL)5OXO4((4PROPAN2YLOXYPHENYL)METHYLIDENE)IMIDAZOL1YL)HEXYL)5((4PROPAN2YLOXYPHENYL)METHYLIDENE)IMIDAZOL4ONE
CC(C)OC1=CC=C(C=C1)C=C2C(=O)N(C(=N2)C3=CC=CC=C3OC)CCCCCCN4C(=NC(=CC5=CC=C(C=C5)OC(C)C)C4=O)C6=CC=CC=C6OC
COc1ccccc1C1=NC(=Cc2ccc(cc2)OC(C)C)C(=O)N1CCCCCCN1C(=O)C(=Cc2ccc(cc2)OC(C)C)N=C1c1ccccc1OC
InChI=1SC46H50N4O6c131(2)5535231933(202435)293945(51)49(43(4739)37159111741(37)535)27137814285044(381610121842(38)546)4840(46(50)52)3034212536(262234)5632(3)4h91215262932H7813142728H216H3b39294030+
MFCD07773935
ZINC000150350310
ZINC150350310
Check stock
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Check stock on Vitas-MAvailable files
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