Vitas-M small molecule compound
cyclopentyl 2-methyl-5-oxo-7-phenyl-4-(pyridin-4-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK083529
SMILES O=C(C1=C(C)NC2=C(C1c1ccncc1)C(=O)CC(C2)c1ccccc1)OC1CCCC1
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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 C27H28N2O3 MW 428.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O3/c1-17-24(27(31)32-21-9-5-6-10-21)25(19-11-13-28-14-12-19)26-22(29-17)15-20(16-23(26)30)18-7-3-2-4-8-18/h2-4,7-8,11-14,20-21,25,29H,5-6,9-10,15-16H2,1H3InChIKey
DJKAJCJVJPXYLX-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=NC=C4)C(=O)OC5CCCC5
cyclopentyl2methyl5oxo7phenyl4(pyridin4yl)145678hexahydroquinoline3carboxylate
cyclopentyl2methyl5oxo7phenyl4pyridin4yl4678tetrahydro1Hquinoline3carboxylate
InChI=1SC27H28N2O3c11724(27(31)32219561021)25(19111328141219)2622(2917)1520(1623(26)30)187324818h2478111420212529H569101516H21H3
MFCD00771490
O=C(C1=C(C)NC2=C(C1c1ccncc1)C(=O)CC(C2)c1ccccc1)OC1CCCC1
STK083529
ZINC000019760668
ZINC000019760676
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