Vitas-M small molecule compound
N-(4-chlorophenyl)-2-{[3-cyano-4-(furan-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide
Catalog ID
STK886628
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)Cl)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 C22H18ClN3O3S MW 439.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN3O3S/c23-13-6-8-14(9-7-13)25-19(28)12-30-22-15(11-24)20(18-5-2-10-29-18)21-16(26-22)3-1-4-17(21)27/h2,5-10,20,26H,1,3-4,12H2,(H,25,28)InChIKey
QOSBQIQRGUTMPP-UHFFFAOYSA-NSynonyms
384355-42-4384355424
C1CC2=C(C(C(=C(N2)SCC(=O)NC3=CC=C(C=C3)Cl)C#N)C4=CC=CO4)C(=O)C1
InChI=1SC22H18ClN3O3Sc23136814(9713)2519(28)12302215(1124)20(1852102918)2116(2622)31417(21)27h25102026H13412H2(H2528)
MFCD03000813
N(4chlorophenyl)2((3cyano4(furan2yl)5oxo145678hexahydroquinolin2yl)sulfanyl)acetamide
N(4chlorophenyl)2((3cyano4(furan2yl)5oxo145678hexahydroquinolin2yl)thio)acetamide
N(4chlorophenyl)2((3cyano4(furan2yl)5oxo4678tetrahydro1Hquinolin2yl)sulfanyl)acetamide
ZINC000002312353
ZINC000002312354
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