Vitas-M small molecule compound
N-[1-benzyl-2-hydroxy-4,6-dioxo-5-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-2-(2-oxopyrrolidin-1-yl)acetamide
Catalog ID
STK936419
SMILES O=C(NC1(C(=O)Nc2c1c(=O)nc(n2Cc1ccccc1)O)C(F)(F)F)CN1CCCC1=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 C20H18F3N5O5 MW 465.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18F3N5O5/c21-20(22,23)19(26-12(29)10-27-8-4-7-13(27)30)14-15(24-17(19)32)28(18(33)25-16(14)31)9-11-5-2-1-3-6-11/h1-3,5-6H,4,7-10H2,(H,24,32)(H,26,29)(H,25,31,33)InChIKey
IUGGUELKBMCQJO-UHFFFAOYSA-NSynonyms
1219582-62-31219582623
C1CC(=O)N(C1)CC(=O)NC2(C3=C(NC2=O)N(C(=O)NC3=O)CC4=CC=CC=C4)C(F)(F)F
InChI=1SC20H18F3N5O5c2120(2223)19(2612(29)102784713(27)30)1415(2417(19)32)28(18(33)2516(14)31)9115213611h1356H4710H2(H2432)(H2629)(H253133)
MFCD18178350
N(1benzyl246trioxo5(trifluoromethyl)7Hpyrrolo(23d)pyrimidin5yl)2(2oxopyrrolidin1yl)acetamide
N(1benzyl2hydroxy46dioxo5(trifluoromethyl)4567tetrahydro1Hpyrrolo(23d)pyrimidin5yl)2(2oxopyrrolidin1yl)acetamide
ZINC000101655251
ZINC000101655253
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