Vitas-M small molecule compound
ethyl 4-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK961443
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1c(C)nn(c1C)CC)C(=O)CC(C2)(C)C
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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 C22H31N3O3 MW 385.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H31N3O3/c1-8-25-14(5)17(13(4)24-25)20-18(21(27)28-9-2)12(3)23-15-10-22(6,7)11-16(26)19(15)20/h20,23H,8-11H2,1-7H3InChIKey
VFXHHRRSLXURAZ-UHFFFAOYSA-NSynonyms
494217-72-0494217720
CCN1C(=C(C(=N1)C)C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OCC)C)C
ethyl4(1ethyl35dimethyl1Hpyrazol4yl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
ethyl4(1ethyl35dimethylpyrazol4yl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
InChI=1SC22H31N3O3c182514(5)17(13(4)2425)2018(21(27)2892)12(3)23151022(67)1116(26)19(15)20h2023H811H217H3
MFCD02374070
ZINC000005526070
ZINC000005526074
Check stock
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Check stock on Vitas-MAvailable files
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