Vitas-M small molecule compound
benzyl 4-[4-(dimethylamino)phenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK038825
SMILES CN(c1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCc1ccccc1)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 C26H28N2O3 MW 416.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O3/c1-17-23(26(30)31-16-18-8-5-4-6-9-18)24(19-12-14-20(15-13-19)28(2)3)25-21(27-17)10-7-11-22(25)29/h4-6,8-9,12-15,24,27H,7,10-11,16H2,1-3H3InChIKey
SDMMNAOPODVPPE-UHFFFAOYSA-NSynonyms
299453-89-7299453897
benzyl4(4(dimethylamino)phenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
benzyl4(4(dimethylamino)phenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)N(C)C)C(=O)OCC4=CC=CC=C4
CN(c1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCc1ccccc1)C
InChI=1SC26H28N2O3c11723(26(30)3116188546918)24(19121420(151319)28(2)3)2521(2717)1071122(25)29h468912152427H7101116H213H3
MFCD00771234
STK038825
ZINC000019731268
ZINC000019731271
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