Vitas-M small molecule compound
cyclohexylmethyl 4-(2-bromo-4,5-dimethoxyphenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Catalog ID
STK406714
SMILES COc1cc(c(cc1OC)Br)C1CC(=O)NC(=C1C(=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 C22H28BrNO5 MW 466.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28BrNO5/c1-13-21(22(26)29-12-14-7-5-4-6-8-14)16(10-20(25)24-13)15-9-18(27-2)19(28-3)11-17(15)23/h9,11,14,16H,4-8,10,12H2,1-3H3,(H,24,25)InChIKey
KGCCBWNLAFADFN-UHFFFAOYSA-NSynonyms
CC1=C(C(CC(=O)N1)C2=CC(=C(C=C2Br)OC)OC)C(=O)OCC3CCCCC3
cyclohexylmethyl4(2bromo45dimethoxyphenyl)2methyl6oxo1456tetrahydropyridine3carboxylate
CYCLOHEXYLMETHYL4(2BROMO45DIMETHOXYPHENYL)2METHYL6OXO145TRIHYDROPYRIDINE3CARBOXYLATE
cyclohexylmethyl4(2bromo45dimethoxyphenyl)6methyl2oxo34dihydro1Hpyridine5carboxylate
InChI=1SC22H28BrNO5c11321(22(26)2912147546814)16(1020(25)2413)15918(272)19(283)1117(15)23h9111416H481012H213H3(H2425)
MFCD07613304
ZINC000009560005
ZINC000009560006
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