Vitas-M small molecule compound

methyl 2-({[2-(4-fluorophenyl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetyl}amino)benzoate

Catalog ID
STL084508
SMILES COC(=O)c1ccccc1NC(=O)Cn1c(=O)cc(nc1c1ccc(cc1)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 C21H18FN3O4 MW 395.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN3O4/c1-13-11-19(27)25(20(23-13)14-7-9-15(22)10-8-14)12-18(26)24-17-6-4-3-5-16(17)21(28)29-2/h3-11H,12H2,1-2H3,(H,24,26)
InChIKey
BNOZRZXSZRFRQQ-UHFFFAOYSA-N
Synonyms
1260922-46-0
1260922460
CC1=CC(=O)N(C(=N1)C2=CC=C(C=C2)F)CC(=O)NC3=CC=CC=C3C(=O)OC
InChI=1SC21H18FN3O4c1131119(27)25(20(2313)147915(22)10814)1218(26)2417643516(17)21(28)292h311H12H212H3(H2426)
methyl2(((2(4fluorophenyl)4methyl6oxopyrimidin1(6H)yl)acetyl)amino)benzoate
methyl2((2(2(4fluorophenyl)4methyl6oxopyrimidin1yl)acetyl)amino)benzoate
MFCD18203078
ZINC000057522261
ZINC57522261

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.