Vitas-M small molecule compound
2-{[3-cyano-4-(2,3-dichlorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide
Catalog ID
STK841609
SMILES N#CC1=C(SCC(=O)N)NC2=C(C1c1cccc(c1Cl)Cl)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 C18H15Cl2N3O2S MW 408.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15Cl2N3O2S/c19-11-4-1-3-9(17(11)20)15-10(7-21)18(26-8-14(22)25)23-12-5-2-6-13(24)16(12)15/h1,3-4,15,23H,2,5-6,8H2,(H2,22,25)InChIKey
XCBGKLSSZSWEPH-UHFFFAOYSA-NSynonyms
488107-36-42((3cyano4(23dichlorophenyl)5oxo145678hexahydroquinolin2yl)sulfanyl)acetamide
2((3cyano4(23dichlorophenyl)5oxo145678hexahydroquinolin2yl)thio)acetamide
2((3cyano4(23dichlorophenyl)5oxo4678tetrahydro1Hquinolin2yl)sulfanyl)acetamide
488107364
C1CC2=C(C(C(=C(N2)SCC(=O)N)C#N)C3=C(C(=CC=C3)Cl)Cl)C(=O)C1
InChI=1SC18H15Cl2N3O2Sc19114139(17(11)20)1510(721)18(26814(22)25)231252613(24)16(12)15h1341523H2568H2(H22225)
MFCD03288829
ZINC000002328636
ZINC000002328637
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