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1 . α-(4-Fluorophenyl)-α-(pyridazin-3-yl)-acetonitrile C12H8N3F 相似度:66.6% Molecules 2007 12 2643-2657 Synthesis of a New Scaffold: the 7H, 8H-Pyrimido[1, 6-b]pyridazin-6, 8-dione Nucleus Franciszek Herold, Małgorzata Kałucka, Marek Król, Joanna Herold, Jerzy Kleps and Jadwiga Turło Structure 13C NMR Structure & 13C NMR 碳谱模拟图 2 . benzyl 1-(5-fluoro-2-hydroxyphenyl)-1-ethylcarbamate C16H16FNO3 相似度:64.2% Molecules 2012 17 6901-6915 Catalytic Asymmetric Hydrogenation of 3-Substituted Benzisoxazoles Ryuhei Ikeda and Ryoichi Kuwano Structure 13C NMR Structure & 13C NMR 碳谱模拟图 3 . (2-furan-2-yl-2-oxoethyl)carbamic acid benzyl ester C14H13NO4 相似度:61.5% Heterocycles 2008 76 1549-1559 De Novo Asymmetric Approaches to 2-Amino-N-(benzyloxycarbonyl)-1-(2'-furyl)ethanol and 2-Amino-N-(tert-butoxycarbonyl)-1-(2'-furyl)ethanol Michael H. Haukaas, Miaosheng Li, Alexey M. Starosotnikov, and George A. O'Doherty Structure 13C NMR Structure & 13C NMR 碳谱模拟图 4 . 3-oxo-3H-benzo[f]chromen-1-yl trifluoromethanesulfonate C14H7F3O5S 相似度:61.5% European Journal of Organic Chemistry 2010 3945-3955 Palladium-Catalyzed Synthesis of 4-Arylcoumarins Using Triarylbismuth Compounds as Atom-Efficient Multicoupling Organometallic Nucleophiles Maddali L. N. Rao, Varadhachari Venkatesh and Deepak N. Jadhav Structure 13C NMR Structure & 13C NMR 碳谱模拟图 5 . 5-(4-fluorophenyl)-2-methylfuran-3-carboxylic acid benzylamide C19H16FNO2 相似度:60% European Journal of Organic Chemistry 2011 4373-4385 Palladium-Catalyzed Direct Arylations of Five-Membered Heteroarenes Bearing N-Monoalkylcarboxamide Substituents Nouria Laidaoui, Julien Roger, Abdellah Miloudi, Douniazad El Abed and Henri Doucet Structure 13C NMR Structure & 13C NMR 碳谱模拟图 6 . 3-((6,7-dimethoxyquinazolin-4-yl)amino)benzonitrile C17H14N4O2 相似度:60% Bioorganic & Medicinal Chemistry 2013 21 7858-7873 Investigation of quinazolines as inhibitors of breast cancer resistance protein (ABCG2) Kapil Juvale, Jennifer Gallus, Michael Wiese Structure 13C NMR Structure & 13C NMR 碳谱模拟图 7 . 2,3-Dihydro-8-methoxy-2-methyl-1H-2-benzazepine 相似度:58.3% Helvetica Chimica Acta 2009 92 2754-2761 A Novel Construction of 2-Benzazepine Scaffold Based on TiCl4-Mediated Tandem Mannich Reaction-Aromatic Electrophilic Substitution Liangxi Li, Zhiming Li, Quanrui Wang Structure 13C NMR Structure & 13C NMR 碳谱模拟图 8 . o-Amino-N-benzylbenzamide 相似度:58.3% Molecules 2004 9 609-616 Syntheses of Quinazoline-2, 4-dione Alkaloids and Analogues from Mexican Zanthoxylum Species I. A. Rivero, K. Espinoza and R. Somanathan Structure 13C NMR Structure & 13C NMR 碳谱模拟图 9 . α-(4-Fluorophenyl)-α-(6-chloropyridazin-3-yl)-acetonitrile C12H7N3FCl 相似度:58.3% Molecules 2007 12 2643-2657 Synthesis of a New Scaffold: the 7H, 8H-Pyrimido[1, 6-b]pyridazin-6, 8-dione Nucleus Franciszek Herold, Małgorzata Kałucka, Marek Król, Joanna Herold, Jerzy Kleps and Jadwiga Turło Structure 13C NMR Structure & 13C NMR 碳谱模拟图 10 . N-hydroxy-2-(5-(4-hydroxyphenyl)-1,3,4-oxadiazol-2-ylamino)pyrimidine-5-carboxamide C13H10N6O4 相似度:58.3% Bioorganic & Medicinal Chemistry Letters 2011 21 5735-5738 2, 5-Disubstituted-1, 3, 4-oxadiazoles/thiadiazole as surface recognition moiety: Design and synthesis of novel hydroxamic acid based histone deacetylase inhibitors Harish Rajak, Avantika Agarawal, Poonam Parmar, Bhupendra Singh Thakur, Ravichandran Veerasamy, Prabodh Chander Sharma, Murli Dhar Kharya Structure 13C NMR Structure & 13C NMR 碳谱模拟图 11 . N-(4-Fluorobenzyl)-2,3-dihydroxy-5-(N-methylsulfamoyl)benzamide C15H15FN2O5S 相似度:58.3% Bioorganic & Medicinal Chemistry 2011 19 4935-4952 Design of HIV-1 integrase inhibitors targeting the catalytic domain as well as its interaction with LEDGF/p75: A scaffold hopping approach using salicylate and catechol groups Xing Fan, Feng-Hua Zhang, Rasha I. Al-Safi, Li-Fan Zeng, Yumna Shabaik, Bikash Debnath, Tino W. Sanchez, Srinivas Odde, Nouri Neamati, Ya-Qiu Long Structure 13C NMR Structure & 13C NMR 碳谱模拟图 12 . 2-(3-(4-hydroxyphenyl)-1H-pyrazol-5-yl))benzenesulfonamide C15H12N3O3S 相似度:58.3% Journal of Heterocyclic Chemistry 2008 45 189-194 Preparation of 2-(1H-pyrazol-5-yl)benzenesulfonamides from polylithiated C(α),N-carbo-tert-butoxyhydrazones and methyl 2-(aminosulfonyl)benzoate John D. Knight,Jordan B. Brown,Jason S. Overby,Charles F. Beam and N. Dwight Camper Structure 13C NMR Structure & 13C NMR 碳谱模拟图 13 . 2-(4'-(4-cyanophenyl)phenyl)-1H-benzimidazole C20H13N3 相似度:58.3% Journal of Heterocyclic Chemistry 2007 44 1521-1523 Synthesis of highly functionalized 2-(substituted biphenyl) benzimidzoles via suzuki-miyaura cross coupling reaction Ramanatham Vinodkumar,Kotarkonda Rajagopal and Nayakanti Devanna Structure 13C NMR Structure & 13C NMR 碳谱模拟图 14 . 7-chloropyrrolo[1,2-a]quinoline C12H8ClN 相似度:58.3% Heterocycles 2007 71 2717-2720 A New Method for the Synthesis of Pyrrolo[1, 2-a]quinolines Based on Boron Trifluoride-Mediated Cyclization of 1-(2-Oxiranylphenyl)pyrroles Kazuhiro Kobayashi, Atsushi Takanohashi, Yasutoshi Himei, Takehiko Sano, Shuhei Fukamachi, Osamu Morikawa, and Hisatoshi Konishi Structure 13C NMR Structure & 13C NMR 碳谱模拟图 15 . 2-amino-N'-phenylbenzohydrazide C13H13N3O 相似度:58.3% Heterocycles 2006 67 161-173 A Diversity Oriented Synthesis of 2,10-Dioxo-10H-1,2,3,4,4a,5-hexahydropyridazino[3,2-b]quinazolines Elisabeth Schuler, Nacho Juanico, Jordi Teixidó, Enrique L. Michelotti, and José I. Borrell* Structure 13C NMR Structure & 13C NMR 碳谱模拟图 16 . 4-benzylthio-3-chloro-6-nitro-1,2-benzisothiazole C14H9N2O2ClS2 相似度:58.3% Heterocycles 2006 68 2483-2498 Synthetic Utilization of Polynitro Aromatic Compounds. 5. Multi-Centered Reactivity Pattern in Reactions of 4,6-Dinitro-1,2-benzisothiazoles and -isothiazol-3(2H)-ones with C-, N-, O-, S-, and F-Nucleophiles Sergei G. Zlotin,* Pavel G. Kislitsin, Fedor A. Kucherov, Evgeny A. Serebryakov, Yury A. Strelenko, and Andrei A. Gakh* Structure 13C NMR Structure & 13C NMR 碳谱模拟图 17 . resveratrol 相似度:58.3% Journal of Shenyang Pharmaceutical University 2009 26 694-696 Isolation and identification of the non-alkaloid constituents from Gelsemium elegans Benth. ZHAO Qing-chun, FU Yan-hui, DU Zhan-quan, HUA Wei, GUO Tao, WU Li-jun Structure 13C NMR Structure & 13C NMR 碳谱模拟图 18 . compound 3x C13H10F2S 相似度:58.3% Tetrahedron 2012 68 4233-4241 Regioselective C–S bond formation accomplished by copper-catalyzed regioselective C–F substitution of perfluoroarenes with aryl thioacetates or benzyl thioacetate Qizhong Zhou, Bin Zhang, Tieqi Du, Haining Gu, Huajiang Jiang, Rener Chen Structure 13C NMR Structure & 13C NMR 碳谱模拟图 19 . 1-benzyl-7-azaisatin C14H10N2O2 相似度:58.3% Heterocycles 2000 53 1145-1150 A Facile Synthesis of 1-Alkyl-7-azaisatins Jiro Tatsugi,* Tong Zhiwei, Tomohiro Amano, and Yasuji Izawa Structure 13C NMR Structure & 13C NMR 碳谱模拟图 20 . 6-hydroxy-2-oxo-2H-chromene-3-carbonitrile C10H5NO3 相似度:58.3% Journal of Heterocyclic Chemistry 2011 48 799-802 ZrCl4/[bmim]BF4-catalyzed condensation of salicylaldehydes and malononitrile: Single-step synthesis of 3-cyanocoumarin derivatives Hassan Valizadeh, Manzar Mahmoodian and Hamid Gholipour Structure 13C NMR Structure & 13C NMR 碳谱模拟图 21 . compound 2b C14H12O4 相似度:58.3% European Journal of Organic Chemistry 2011 1099-1105 Ring-Opening Reaction of Vinylidenecyclopropanediesters Catalyzed by Re2(CO)10 or Yb(OTf)3 Lei Wu and Min Shi Structure 13C NMR Structure & 13C NMR 碳谱模拟图 |

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