Vitas-M small molecule compound
4-(4-ethoxyphenyl)-2-(methylsulfanyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK839530
SMILES CCOc1ccc(cc1)C1C(=C(SC)NC2=C1C(=O)CCC2)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 C19H20N2O2S MW 340.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O2S/c1-3-23-13-9-7-12(8-10-13)17-14(11-20)19(24-2)21-15-5-4-6-16(22)18(15)17/h7-10,17,21H,3-6H2,1-2H3InChIKey
BENFPVOLSMCNOJ-UHFFFAOYSA-NSynonyms
383894-65-3383894653
4(4ethoxyphenyl)2(methylsulfanyl)5oxo145678hexahydroquinoline3carbonitrile
4(4ethoxyphenyl)2(methylthio)5oxo145678hexahydroquinoline3carbonitrile
4(4ethoxyphenyl)2methylsulfanyl5oxo4678tetrahydro1Hquinoline3carbonitrile
CCOC1=CC=C(C=C1)C2C(=C(NC3=C2C(=O)CCC3)SC)C#N
InChI=1SC19H20N2O2Sc1323139712(81013)1714(1120)19(242)211554616(22)18(15)17h7101721H36H212H3
MFCD03000677
ZINC000000459036
ZINC000000459038
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