Vitas-M small molecule compound

methyl 2-({[5-(2-hydroxyethyl)-4-methyl-6-oxo-2-[4-(trifluoromethyl)phenyl]pyrimidin-1(6H)-yl]acetyl}amino)benzoate

Catalog ID
STL110398
SMILES OCCc1c(C)nc(n(c1=O)CC(=O)Nc1ccccc1C(=O)OC)c1ccc(cc1)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 C24H22F3N3O5 MW 489.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22F3N3O5/c1-14-17(11-12-31)22(33)30(21(28-14)15-7-9-16(10-8-15)24(25,26)27)13-20(32)29-19-6-4-3-5-18(19)23(34)35-2/h3-10,31H,11-13H2,1-2H3,(H,29,32)
InChIKey
UARBFRMBIUNXPZ-UHFFFAOYSA-N
Synonyms

CC1=C(C(=O)N(C(=N1)C2=CC=C(C=C2)C(F)(F)F)CC(=O)NC3=CC=CC=C3C(=O)OC)CCO
InChI=1SC24H22F3N3O5c11417(111231)22(33)30(21(2814)157916(10815)24(2526)27)1320(32)2919643518(19)23(34)352h31031H1113H212H3(H2932)
methyl2(((5(2hydroxyethyl)4methyl6oxo2(4(trifluoromethyl)phenyl)pyrimidin1(6H)yl)acetyl)amino)benzoate
methyl2((2(5(2hydroxyethyl)4methyl6oxo2(4(trifluoromethyl)phenyl)pyrimidin1yl)acetyl)amino)benzoate
MFCD20745246
ZINC000067301235
ZINC67301235

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Available files

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