Vitas-M small molecule compound

5-(azepan-1-yl)-2-(4-methoxyphenyl)-1,3-oxazole-4-carbonitrile

Catalog ID
STK896316
SMILES N#Cc1nc(oc1N1CCCCCC1)c1ccc(cc1)OC

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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 C17H19N3O2 MW 297.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O2/c1-21-14-8-6-13(7-9-14)16-19-15(12-18)17(22-16)20-10-4-2-3-5-11-20/h6-9H,2-5,10-11H2,1H3
InChIKey
DAAIJRXRTWDBNW-UHFFFAOYSA-N
Synonyms
613651-25-5
5(1AZEPANYL)2(4METHOXYPHENYL)13OXAZOLE4CARBONITRILE
5(azepan1yl)2(4methoxyphenyl)13oxazole4carbonitrile
5(azepan1yl)2(4methoxyphenyl)oxazole4carbonitrile
613651255
COC1=CC=C(C=C1)C2=NC(=C(O2)N3CCCCCC3)C#N
InChI=1SC17H19N3O2c121148613(7914)161915(1218)17(2216)201042351120h69H251011H21H3
MFCD03490743
ZINC000000467975
ZINC00467975
ZINC467975

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Available files

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