Vitas-M small molecule compound
N-{1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}propanamide
Catalog ID
STK773922
SMILES CCC(=O)NC1(C(=O)Nc2c1c(=O)[nH]c(=O)n2CCc1ccc(c(c1)OC)OC)C(F)(F)F
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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 C20H21F3N4O6 MW 470.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21F3N4O6/c1-4-13(28)26-19(20(21,22)23)14-15(24-17(19)30)27(18(31)25-16(14)29)8-7-10-5-6-11(32-2)12(9-10)33-3/h5-6,9H,4,7-8H2,1-3H3,(H,24,30)(H,26,28)(H,25,29,31)InChIKey
DEVKQXFULQVJCI-UHFFFAOYSA-NSynonyms
695202-46-1CCC(=O)NC1(C(=O)Nc2c1c(=O)(nH)c(=O)n2CCc1ccc(c(c1)OC)OC)C(F)(F)F
CCC(=O)NC1(C2=C(NC1=O)N(C(=O)NC2=O)CCC3=CC(=C(C=C3)OC)OC)C(F)(F)F
InChI=1SC20H21F3N4O6c1413(28)2619(20(2122)23)1415(2417(19)30)27(18(31)2516(14)29)87105611(322)12(910)333h569H478H213H3(H2430)(H2628)(H252931)
MFCD03855849
N(1(2(34dimethoxyphenyl)ethyl)246trioxo5(trifluoromethyl)234567hexahydro1Hpyrrolo(23d)pyrimidin5yl)propanamide
N(1(2(34DIMETHOXYPHENYL)ETHYL)246TRIOXO5(TRIFLUOROMETHYL)7HPYRROLO(23D)PYRIMIDIN5YL)PROPANAMIDE
N(1(34dimethoxyphenethyl)246trioxo5(trifluoromethyl)234567hexahydro1Hpyrrolo(23d)pyrimidin5yl)propionamide
ZINC000001874361
ZINC000001874363
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.