Vitas-M small molecule compound
4-(2,3-dichlorophenyl)-2-(hexylsulfanyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK542056
SMILES CCCCCCSC1=C(C(C2=C(N1)CCCC2=O)c1cccc(c1Cl)Cl)C#N
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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 C22H24Cl2N2OS MW 435.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24Cl2N2OS/c1-2-3-4-5-12-28-22-15(13-25)19(14-8-6-9-16(23)21(14)24)20-17(26-22)10-7-11-18(20)27/h6,8-9,19,26H,2-5,7,10-12H2,1H3InChIKey
XBZIRCWBKNVKQD-UHFFFAOYSA-NSynonyms
488812-18-64(23dichlorophenyl)2(hexylsulfanyl)5oxo145678hexahydroquinoline3carbonitrile
4(23dichlorophenyl)2(hexylthio)5oxo145678hexahydroquinoline3carbonitrile
4(23dichlorophenyl)2hexylsulfanyl5oxo4678tetrahydro1Hquinoline3carbonitrile
488812186
CCCCCCSC1=C(C(C2=C(N1)CCCC2=O)C3=C(C(=CC=C3)Cl)Cl)C#N
InChI=1SC22H24Cl2N2OSc1234512282215(1325)19(1486916(23)21(14)24)2017(2622)1071118(20)27h6891926H2571012H21H3
MFCD03293555
ZINC000002359806
ZINC000013166253
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