Vitas-M small molecule compound
2-{[3-cyano-4-(4-hydroxy-3-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(4-nitrophenyl)acetamide
Catalog ID
STK552979
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)[N+](=O)[O-])NC2=C(C1c1ccc(c(c1)OC)O)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 C25H22N4O6S MW 506.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O6S/c1-35-21-11-14(5-10-19(21)30)23-17(12-26)25(28-18-3-2-4-20(31)24(18)23)36-13-22(32)27-15-6-8-16(9-7-15)29(33)34/h5-11,23,28,30H,2-4,13H2,1H3,(H,27,32)InChIKey
ZXSGOQPHVPNLSE-UHFFFAOYSA-NSynonyms
799772-87-52((3cyano4(4hydroxy3methoxyphenyl)5oxo145678hexahydroquinolin2yl)sulfanyl)N(4nitrophenyl)acetamide
2((3cyano4(4hydroxy3methoxyphenyl)5oxo145678hexahydroquinolin2yl)thio)N(4nitrophenyl)acetamide
2((3cyano4(4hydroxy3methoxyphenyl)5oxo4678tetrahydro1Hquinolin2yl)sulfanyl)N(4nitrophenyl)acetamide
799772875
COC1=C(C=CC(=C1)C2C(=C(NC3=C2C(=O)CCC3)SCC(=O)NC4=CC=C(C=C4)(N+)(=O)(O))C#N)O
InChI=1SC25H22N4O6Sc135211114(51019(21)30)2317(1226)25(281832420(31)24(18)23)361322(32)27156816(9715)29(33)34h511232830H2413H21H3(H2732)
MFCD03672428
N#CC1=C(SCC(=O)Nc2ccc(cc2)(N+)(=O)(O))NC2=C(C1c1ccc(c(c1)OC)O)C(=O)CCC2
ZINC000020170823
ZINC000020170824
Check stock
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