Vitas-M small molecule compound
4-(2,3-dichlorophenyl)-2-(methylsulfanyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK841344
SMILES CSC1=C(C#N)C(C2=C(N1)CCCC2=O)c1cccc(c1Cl)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 C17H14Cl2N2OS MW 365.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14Cl2N2OS/c1-23-17-10(8-20)14(9-4-2-5-11(18)16(9)19)15-12(21-17)6-3-7-13(15)22/h2,4-5,14,21H,3,6-7H2,1H3InChIKey
CAUXBTQLIDSYRZ-UHFFFAOYSA-NSynonyms
487036-35-14(23dichlorophenyl)2(methylsulfanyl)5oxo145678hexahydroquinoline3carbonitrile
4(23dichlorophenyl)2(methylthio)5oxo145678hexahydroquinoline3carbonitrile
4(23dichlorophenyl)2methylsulfanyl5oxo4678tetrahydro1Hquinoline3carbonitrile
487036351
CSC1=C(C(C2=C(N1)CCCC2=O)C3=C(C(=CC=C3)Cl)Cl)C#N
InChI=1SC17H14Cl2N2OSc1231710(820)14(942511(18)16(9)19)1512(2117)63713(15)22h2451421H367H21H3
MFCD03287288
ZINC000013284544
ZINC000013284545
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