Vitas-M small molecule compound
N-(4-chlorophenyl)-2-{[3-cyano-4-(2-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide
Catalog ID
STK538302
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)Cl)NC2=C(C1c1ccccc1OC)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 C25H22ClN3O3S MW 479.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O3S/c1-32-21-8-3-2-5-17(21)23-18(13-27)25(29-19-6-4-7-20(30)24(19)23)33-14-22(31)28-16-11-9-15(26)10-12-16/h2-3,5,8-12,23,29H,4,6-7,14H2,1H3,(H,28,31)InChIKey
XKEPSIVOUOGOHX-UHFFFAOYSA-NSynonyms
383894-88-0383894880
COC1=CC=CC=C1C2C(=C(NC3=C2C(=O)CCC3)SCC(=O)NC4=CC=C(C=C4)Cl)C#N
InChI=1SC25H22ClN3O3Sc13221832517(21)2318(1327)25(291964720(30)24(19)23)331422(31)281611915(26)101216h2358122329H46714H21H3(H2831)
MFCD03000696
N(4chlorophenyl)2((3cyano4(2methoxyphenyl)5oxo145678hexahydroquinolin2yl)sulfanyl)acetamide
N(4chlorophenyl)2((3cyano4(2methoxyphenyl)5oxo145678hexahydroquinolin2yl)thio)acetamide
N(4chlorophenyl)2((3cyano4(2methoxyphenyl)5oxo4678tetrahydro1Hquinolin2yl)sulfanyl)acetamide
ZINC000002312168
ZINC000002312169
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