Vitas-M small molecule compound

3-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-N-(2-cyanocyclopent-1-en-1-yl)-2-methylpropanamide

Catalog ID
STL400583
SMILES N#CC1=C(CCC1)NC(=O)C(Cn1nc(c(c1C)Br)C)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 C15H19BrN4O MW 351.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19BrN4O/c1-9(8-20-11(3)14(16)10(2)19-20)15(21)18-13-6-4-5-12(13)7-17/h9H,4-6,8H2,1-3H3,(H,18,21)
InChIKey
ZJGJURPZHYIXCW-UHFFFAOYSA-N
Synonyms
1005624-08-7
1005624087
3(4bromo35dimethyl1Hpyrazol1yl)N(2cyanocyclopent1en1yl)2methylpropanamide
3(4BROMO35DIMETHYLPYRAZOL1YL)N(2CYANOCYCLOPENTEN1YL)2METHYLPROPANAMIDE
3(4BROMO35DIMETHYLPYRAZOLYL)N(2CYANOCYCLOPENT1ENYL)2METHYLPROPANAMIDE
CC1=C(C(=NN1CC(C)C(=O)NC2=C(CCC2)C#N)C)Br
InChI=1SC15H19BrN4Oc19(82011(3)14(16)10(2)1920)15(21)181364512(13)717h9H468H213H3(H1821)
MFCD04053877
ZINC000006526406
ZINC000006526432

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Available files

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