Vitas-M small molecule compound
N-[1-butyl-4-hydroxy-2,6-dioxo-5-(trifluoromethyl)-2,5,6,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-3-cyclohexylpropanamide
Catalog ID
STK626016
SMILES CCCCn1c(=O)nc(c2c1NC(=O)C2(NC(=O)CCC1CCCCC1)C(F)(F)F)O
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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 C20H27F3N4O4 MW 444.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27F3N4O4/c1-2-3-11-27-15-14(16(29)25-18(27)31)19(17(30)24-15,20(21,22)23)26-13(28)10-9-12-7-5-4-6-8-12/h12H,2-11H2,1H3,(H,24,30)(H,26,28)(H,25,29,31)InChIKey
FMYMXFGSTIZROW-UHFFFAOYSA-NSynonyms
919749-71-6919749716
CCCCN1C2=C(C(=O)NC1=O)C(C(=O)N2)(C(F)(F)F)NC(=O)CCC3CCCCC3
InChI=1SC20H27F3N4O4c12311271514(16(29)2518(27)31)19(17(30)241520(2122)23)2613(28)109127546812h12H211H21H3(H2430)(H2628)(H252931)
MFCD09797159
N(1butyl246trioxo5(trifluoromethyl)7Hpyrrolo(23d)pyrimidin5yl)3cyclohexylpropanamide
N(1butyl4hydroxy26dioxo5(trifluoromethyl)2567tetrahydro1Hpyrrolo(23d)pyrimidin5yl)3cyclohexylpropanamide
ZINC000009420116
ZINC000009420117
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