Vitas-M small molecule compound

ethyl 1-{[2-(3-chlorophenyl)-4-ethyl-6-oxopyrimidin-1(6H)-yl]acetyl}piperidine-3-carboxylate

Catalog ID
STL088236
SMILES CCOC(=O)C1CCCN(C1)C(=O)Cn1c(=O)cc(nc1c1cccc(c1)Cl)CC

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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 C22H26ClN3O4 MW 431.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26ClN3O4/c1-3-18-12-19(27)26(21(24-18)15-7-5-9-17(23)11-15)14-20(28)25-10-6-8-16(13-25)22(29)30-4-2/h5,7,9,11-12,16H,3-4,6,8,10,13-14H2,1-2H3
InChIKey
NRXIEEFSKDUXST-UHFFFAOYSA-N
Synonyms

CCC1=CC(=O)N(C(=N1)C2=CC(=CC=C2)Cl)CC(=O)N3CCCC(C3)C(=O)OCC
ethyl1((2(3chlorophenyl)4ethyl6oxopyrimidin1(6H)yl)acetyl)piperidine3carboxylate
ethyl1(2(2(3chlorophenyl)4ethyl6oxopyrimidin1yl)acetyl)piperidine3carboxylate
InChI=1SC22H26ClN3O4c13181219(27)26(21(2418)1575917(23)1115)1420(28)25106816(1325)22(29)3042h579111216H3468101314H212H3
MFCD18204223
ZINC000057527555
ZINC000057527558

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Available files

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