Vitas-M small molecule compound

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-methoxyphenyl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamide

Catalog ID
STL115696
SMILES COc1ccc(cc1)c1nc(C)cc(=O)n1CC(=O)Nc1ccc2c(c1)OCCO2

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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 C22H21N3O5 MW 407.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O5/c1-14-11-21(27)25(22(23-14)15-3-6-17(28-2)7-4-15)13-20(26)24-16-5-8-18-19(12-16)30-10-9-29-18/h3-8,11-12H,9-10,13H2,1-2H3,(H,24,26)
InChIKey
PXNHLDRFWHAJIR-UHFFFAOYSA-N
Synonyms

CC1=CC(=O)N(C(=N1)C2=CC=C(C=C2)OC)CC(=O)NC3=CC4=C(C=C3)OCCO4
InChI=1SC22H21N3O5c1141121(27)25(22(2314)153617(282)7415)1320(26)2416581819(1216)301092918h381112H91013H212H3(H2426)
MFCD20732416
N(23dihydro14benzodioxin6yl)2(2(4methoxyphenyl)4methyl6oxopyrimidin1(6H)yl)acetamide
N(23dihydro14benzodioxin6yl)2(2(4methoxyphenyl)4methyl6oxopyrimidin1yl)acetamide
ZINC000067198634
ZINC67198634

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Available files

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