Vitas-M small molecule compound
N-(2-chloro-4-methylphenyl)-2-{[3-cyano-4-(2-fluorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetamide
Catalog ID
STK827597
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2Cl)C)NC(=O)CC1c1ccccc1F
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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 C21H17ClFN3O2S MW 429.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClFN3O2S/c1-12-6-7-18(16(22)8-12)25-20(28)11-29-21-15(10-24)14(9-19(27)26-21)13-4-2-3-5-17(13)23/h2-8,14H,9,11H2,1H3,(H,25,28)(H,26,27)InChIKey
JLZMOSRGIZBUBQ-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)NC(=O)CSC2=C(C(CC(=O)N2)C3=CC=CC=C3F)C#N)Cl
InChI=1SC21H17ClFN3O2Sc1126718(16(22)812)2520(28)11292115(1024)14(919(27)2621)13423517(13)23h2814H911H21H3(H2528)(H2627)
MFCD10088117
N(2chloro4methylphenyl)2((3cyano4(2fluorophenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)acetamide
N(2chloro4methylphenyl)2((5cyano4(2fluorophenyl)2oxo34dihydro1Hpyridin6yl)sulfanyl)acetamide
ZINC000012276869
ZINC000012276870
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