Vitas-M small molecule compound
ethyl 4-(acetylamino)-1-cyclohexyl-2-methyl-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK683077
SMILES CCOC(=O)C1=C(C)N(C(=O)C1(NC(=O)C)C(F)(F)F)C1CCCCC1
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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 C17H23F3N2O4 MW 376.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23F3N2O4/c1-4-26-14(24)13-10(2)22(12-8-6-5-7-9-12)15(25)16(13,17(18,19)20)21-11(3)23/h12H,4-9H2,1-3H3,(H,21,23)InChIKey
ZRNDZOFTYAQUJB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C(=O)C1(C(F)(F)F)NC(=O)C)C2CCCCC2)C
ethyl4(acetylamino)1cyclohexyl2methyl5oxo4(trifluoromethyl)45dihydro1Hpyrrole3carboxylate
ETHYL4ACETAMIDO1CYCLOHEXYL2METHYL5OXO4(TRIFLUOROMETHYL)PYRROLE3CARBOXYLATE
InChI=1SC17H23F3N2O4c142614(24)1310(2)22(128657912)15(25)16(1317(1819)20)2111(3)23h12H49H213H3(H2123)
MFCD04061958
ZINC000004685898
ZINC000004685899
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