Vitas-M small molecule compound
2,2,2-trifluoroethyl 4-[4-(benzyloxy)-3-methoxyphenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK083084
SMILES COc1cc(ccc1OCc1ccccc1)C1NC(=O)NC(=C1C(=O)OCC(F)(F)F)C
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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 C22H21F3N2O5 MW 450.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21F3N2O5/c1-13-18(20(28)32-12-22(23,24)25)19(27-21(29)26-13)15-8-9-16(17(10-15)30-2)31-11-14-6-4-3-5-7-14/h3-10,19H,11-12H2,1-2H3,(H2,26,27,29)InChIKey
QSVTXGMGDFRDHH-UHFFFAOYSA-NSynonyms
222TRIFLUOROETHYL4(3METHOXY4PHENYLMETHOXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
222trifluoroethyl4(4(benzyloxy)3methoxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
222TRIFLUOROETHYL6(3METHOXY4(PHENYLMETHOXY)PHENYL)4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
CC1=C(C(NC(=O)N1)C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)C(=O)OCC(F)(F)F
COc1cc(ccc1OCc1ccccc1)C1NC(=O)NC(=C1C(=O)OCC(F)(F)F)C
InChI=1SC22H21F3N2O5c11318(20(28)321222(2324)25)19(2721(29)2613)158916(17(1015)302)3111146435714h31019H1112H212H3(H2262729)
MFCD01192786
STK083084
ZINC000000847707
ZINC000000847708
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