Vitas-M small molecule compound
2-{[3-cyano-4-(furan-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
Catalog ID
STK886364
SMILES N#CC1=C(SCC(=O)Nc2ccccc2F)NC2=C(C1c1ccco1)C(=O)CCC2
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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 C22H18FN3O3S MW 423.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18FN3O3S/c23-14-5-1-2-6-15(14)25-19(28)12-30-22-13(11-24)20(18-9-4-10-29-18)21-16(26-22)7-3-8-17(21)27/h1-2,4-6,9-10,20,26H,3,7-8,12H2,(H,25,28)InChIKey
KDCKTLCXSHPKKC-UHFFFAOYSA-NSynonyms
799783-86-12((3cyano4(furan2yl)5oxo145678hexahydroquinolin2yl)sulfanyl)N(2fluorophenyl)acetamide
2((3cyano4(furan2yl)5oxo145678hexahydroquinolin2yl)thio)N(2fluorophenyl)acetamide
2((3cyano4(furan2yl)5oxo4678tetrahydro1Hquinolin2yl)sulfanyl)N(2fluorophenyl)acetamide
799783861
C1CC2=C(C(C(=C(N2)SCC(=O)NC3=CC=CC=C3F)C#N)C4=CC=CO4)C(=O)C1
InChI=1SC22H18FN3O3Sc2314512615(14)2519(28)12302213(1124)20(1894102918)2116(2622)73817(21)27h12469102026H37812H2(H2528)
MFCD03674779
ZINC000013080685
ZINC000013080686
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