Vitas-M small molecule compound

9-(2,5-dimethoxyphenyl)-6,6-dimethyl-8-oxo-4,5,6,7,8,9-hexahydropyrazolo[5,1-b]quinazoline-3-carbonitrile

Catalog ID
STK938070
SMILES COc1ccc(c(c1)C1C2=C(Nc3n1ncc3C#N)CC(CC2=O)(C)C)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 C21H22N4O3 MW 378.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O3/c1-21(2)8-15-18(16(26)9-21)19(25-20(24-15)12(10-22)11-23-25)14-7-13(27-3)5-6-17(14)28-4/h5-7,11,19,24H,8-9H2,1-4H3
InChIKey
BKXSIQVCDZYIPM-UHFFFAOYSA-N
Synonyms
1219576-97-2
1219576972
9(25dimethoxyphenyl)66dimethyl8oxo456789hexahydropyrazolo(51b)quinazoline3carbonitrile
MFCD16626099
ZINC000040286071
ZINC000040286073

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Available files

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