Vitas-M small molecule compound

6-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-5-[(4-methoxyphenyl)carbonyl]-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one

Catalog ID
STK822170
SMILES CCOc1cc(ccc1O)C1NC(=O)NC(C1C(=O)c1ccc(cc1)OC)(O)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 C21H21F3N2O6 MW 454.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21F3N2O6/c1-3-32-15-10-12(6-9-14(15)27)17-16(18(28)11-4-7-13(31-2)8-5-11)20(30,21(22,23)24)26-19(29)25-17/h4-10,16-17,27,30H,3H2,1-2H3,(H2,25,26,29)
InChIKey
KGUWKAPJHDUIMD-UHFFFAOYSA-N
Synonyms
1005054-35-2
1005054352
6(3ethoxy4hydroxyphenyl)4hydroxy5((4methoxyphenyl)carbonyl)4(trifluoromethyl)tetrahydropyrimidin2(1H)one
6(3ETHOXY4HYDROXYPHENYL)4HYDROXY5(4METHOXYBENZOYL)4(TRIFLUOROMETHYL)13DIAZINAN2ONE
6(3ETHOXY4HYDROXYPHENYL)4HYDROXY5(4METHOXYBENZOYL)4TRIFLUOROMETHYLTETRAHYDROPYRIMIDIN2ONE
CCOC1=C(C=CC(=C1)C2C(C(NC(=O)N2)(C(F)(F)F)O)C(=O)C3=CC=C(C=C3)OC)O
InChI=1SC21H21F3N2O6c1332151012(6914(15)27)1716(18(28)114713(312)8511)20(3021(2223)24)2619(29)2517h41016172730H3H212H3(H2252629)
MFCD03017219
ZINC000000909090
ZINC000238900818

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Available files

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