Vitas-M small molecule compound
4-(4-chlorophenyl)-2-(methylsulfanyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK725925
SMILES CSC1=C(C#N)C(C2=C(N1)CCCC2=O)c1ccc(cc1)Cl
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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 C17H15ClN2OS MW 330.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15ClN2OS/c1-22-17-12(9-19)15(10-5-7-11(18)8-6-10)16-13(20-17)3-2-4-14(16)21/h5-8,15,20H,2-4H2,1H3InChIKey
RLPLSUDVANIUMP-UHFFFAOYSA-NSynonyms
4(4chlorophenyl)2(methylsulfanyl)5oxo145678hexahydroquinoline3carbonitrile
4(4chlorophenyl)2(methylthio)5oxo145678hexahydroquinoline3carbonitrile
4(4chlorophenyl)2methylsulfanyl5oxo4678tetrahydro1Hquinoline3carbonitrile
CSC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)Cl)C#N
InChI=1SC17H15ClN2OSc1221712(919)15(105711(18)8610)1613(2017)32414(16)21h581520H24H21H3
MFCD02225528
ZINC000019892780
ZINC000019892783
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