Vitas-M small molecule compound
N-{1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2,6-dioxo-5-(trifluoromethyl)-2,5,6,7-tetrahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}-2-methoxybenzamide
Catalog ID
STL054115
SMILES COc1cc(ccc1OC)CCn1c(=O)nc(c2c1NC(=O)C2(NC(=O)c1ccccc1OC)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 C25H23F3N4O7 MW 548.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23F3N4O7/c1-37-15-7-5-4-6-14(15)20(33)31-24(25(26,27)28)18-19(29-22(24)35)32(23(36)30-21(18)34)11-10-13-8-9-16(38-2)17(12-13)39-3/h4-9,12H,10-11H2,1-3H3,(H,29,35)(H,31,33)(H,30,34,36)InChIKey
RRCMRONOXDSBAE-UHFFFAOYSA-NSynonyms
713505-58-9713505589
COC1=C(C=C(C=C1)CCN2C3=C(C(=O)NC2=O)C(C(=O)N3)(C(F)(F)F)NC(=O)C4=CC=CC=C4OC)OC
InChI=1SC25H23F3N4O7c13715754614(15)20(33)3124(25(2627)28)1819(2922(24)35)32(23(36)3021(18)34)1110138916(382)17(1213)393h4912H1011H213H3(H2935)(H3133)(H303436)
MFCD05734367
N(1(2(34DIMETHOXYPHENYL)ETHYL)246TRIOXO5(TRIFLUOROMETHYL)7HPYRROLO(23D)PYRIMIDIN5YL)2METHOXYBENZAMIDE
N(1(2(34dimethoxyphenyl)ethyl)4hydroxy26dioxo5(trifluoromethyl)2567tetrahydro1Hpyrrolo(23d)pyrimidin5yl)2methoxybenzamide
ZINC000001892527
ZINC000001892531
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