Vitas-M small molecule compound
2-({3-cyano-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinolin-2-yl}sulfanyl)-N-(3,4-dimethylphenyl)acetamide
Catalog ID
STK839531
SMILES N#CC1=C(SCC(=O)Nc2ccc(c(c2)C)C)NC2=C(C1c1ccccc1C(F)(F)F)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 C27H24F3N3O2S MW 511.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24F3N3O2S/c1-15-10-11-17(12-16(15)2)32-23(35)14-36-26-19(13-31)24(25-21(33-26)8-5-9-22(25)34)18-6-3-4-7-20(18)27(28,29)30/h3-4,6-7,10-12,24,33H,5,8-9,14H2,1-2H3,(H,32,35)InChIKey
OVGJHVYMXOHOSJ-UHFFFAOYSA-NSynonyms
370847-04-42((3cyano5oxo4(2(trifluoromethyl)phenyl)145678hexahydroquinolin2yl)sulfanyl)N(34dimethylphenyl)acetamide
2((3cyano5oxo4(2(trifluoromethyl)phenyl)145678hexahydroquinolin2yl)thio)N(34dimethylphenyl)acetamide
2((3cyano5oxo4(2(trifluoromethyl)phenyl)4678tetrahydro1Hquinolin2yl)sulfanyl)N(34dimethylphenyl)acetamide
370847044
CC1=C(C=C(C=C1)NC(=O)CSC2=C(C(C3=C(N2)CCCC3=O)C4=CC=CC=C4C(F)(F)F)C#N)C
InChI=1SC27H24F3N3O2Sc115101117(1216(15)2)3223(35)14362619(1331)24(2521(3326)85922(25)34)18634720(18)27(2829)30h346710122433H58914H212H3(H3235)
MFCD02999271
ZINC000013174255
ZINC000013174361
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