Vitas-M small molecule compound
ethyl 2-ethyl-7,7-dimethyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK366662
SMILES CCOC(=O)C1=C(CC)NC2=C(C1c1cccnc1)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 C21H26N2O3 MW 354.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O3/c1-5-14-19(20(25)26-6-2)17(13-8-7-9-22-12-13)18-15(23-14)10-21(3,4)11-16(18)24/h7-9,12,17,23H,5-6,10-11H2,1-4H3InChIKey
YQIOYIPSPCELDE-UHFFFAOYSA-NSynonyms
CCC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CN=CC=C3)C(=O)OCC
ethyl2ethyl77dimethyl5oxo4(pyridin3yl)145678hexahydroquinoline3carboxylate
ethyl2ethyl77dimethyl5oxo4pyridin3yl1468tetrahydroquinoline3carboxylate
InChI=1SC21H26N2O3c151419(20(25)2662)17(13879221213)1815(2314)1021(34)1116(18)24h79121723H561011H214H3
MFCD00368157
ZINC000022520957
ZINC000022520961
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