Vitas-M small molecule compound
pentyl 2,7,7-trimethyl-5-oxo-4-(pyridin-4-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372730
SMILES CCCCCOC(=O)C1=C(C)NC2=C(C1c1ccncc1)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 C23H30N2O3 MW 382.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N2O3/c1-5-6-7-12-28-22(27)19-15(2)25-17-13-23(3,4)14-18(26)21(17)20(19)16-8-10-24-11-9-16/h8-11,20,25H,5-7,12-14H2,1-4H3InChIKey
SUXCWUCCDQXWJV-UHFFFAOYSA-NSynonyms
CCCCCOC(=O)C1=C(NC2=C(C1C3=CC=NC=C3)C(=O)CC(C2)(C)C)C
InChI=1SC23H30N2O3c1567122822(27)1915(2)25171323(34)1418(26)21(17)20(19)168102411916h8112025H571214H214H3
MFCD00628175
pentyl277trimethyl5oxo4(pyridin4yl)145678hexahydroquinoline3carboxylate
pentyl277trimethyl5oxo4pyridin4yl1468tetrahydroquinoline3carboxylate
ZINC000019228792
ZINC000019228794
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