Vitas-M small molecule compound
2-methylpropyl 4-(3-chlorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363574
SMILES CC(COC(=O)C1=C(C)NC2=C(C1c1cccc(c1)Cl)C(=O)CC(C2)c1ccccc1)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 C27H28ClNO3 MW 449.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28ClNO3/c1-16(2)15-32-27(31)24-17(3)29-22-13-20(18-8-5-4-6-9-18)14-23(30)26(22)25(24)19-10-7-11-21(28)12-19/h4-12,16,20,25,29H,13-15H2,1-3H3InChIKey
PPJAPMPUIWUORI-UHFFFAOYSA-NSynonyms
2methylpropyl4(3chlorophenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
2methylpropyl4(3chlorophenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC(=CC=C4)Cl)C(=O)OCC(C)C
InChI=1SC27H28ClNO3c116(2)153227(31)2417(3)29221320(188546918)1423(30)26(22)25(24)191071121(28)1219h41216202529H1315H213H3
MFCD01445642
ZINC000000666744
ZINC000000666754
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Check stock on Vitas-MAvailable files
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