Vitas-M small molecule compound
2-methylpropyl 7-(4-methoxyphenyl)-2-methyl-5-oxo-4-(pyridin-4-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363738
SMILES COc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1ccncc1)C(=O)OCC(C)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 C27H30N2O4 MW 446.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O4/c1-16(2)15-33-27(31)24-17(3)29-22-13-20(18-5-7-21(32-4)8-6-18)14-23(30)26(22)25(24)19-9-11-28-12-10-19/h5-12,16,20,25,29H,13-15H2,1-4H3InChIKey
RIHPDXNXLIKYNO-UHFFFAOYSA-NSynonyms
2methylpropyl7(4methoxyphenyl)2methyl5oxo4(pyridin4yl)145678hexahydroquinoline3carboxylate
2methylpropyl7(4methoxyphenyl)2methyl5oxo4pyridin4yl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)OC)C4=CC=NC=C4)C(=O)OCC(C)C
InChI=1SC27H30N2O4c116(2)153327(31)2417(3)29221320(185721(324)8618)1423(30)26(22)25(24)1991128121019h51216202529H1315H214H3
MFCD01571955
ZINC000019644830
ZINC000019644839
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