Vitas-M small molecule compound
2-{[3-cyano-4-(2-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Catalog ID
STK886667
SMILES N#CC1=C(SCC(=O)Nc2cccc(c2)OC)NC2=C(C1c1ccccc1C)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 C26H25N3O3S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O3S/c1-16-7-3-4-10-19(16)24-20(14-27)26(29-21-11-6-12-22(30)25(21)24)33-15-23(31)28-17-8-5-9-18(13-17)32-2/h3-5,7-10,13,24,29H,6,11-12,15H2,1-2H3,(H,28,31)InChIKey
KPWPZHFWIPWWKB-UHFFFAOYSA-NSynonyms
370845-17-32((3cyano4(2methylphenyl)5oxo145678hexahydroquinolin2yl)sulfanyl)N(3methoxyphenyl)acetamide
2((3cyano4(2methylphenyl)5oxo4678tetrahydro1Hquinolin2yl)sulfanyl)N(3methoxyphenyl)acetamide
2((3cyano5oxo4(otolyl)145678hexahydroquinolin2yl)thio)N(3methoxyphenyl)acetamide
370845173
CC1=CC=CC=C1C2C(=C(NC3=C2C(=O)CCC3)SCC(=O)NC4=CC(=CC=C4)OC)C#N
InChI=1SC26H25N3O3Sc1167341019(16)2420(1427)26(29211161222(30)25(21)24)331523(31)281785918(1317)322h35710132429H6111215H212H3(H2831)
MFCD02999364
ZINC000002309729
ZINC000002309730
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