Vitas-M small molecule compound

4-bromo-N-[3,3-dimethyl-1-(1H-pyrazol-1-yl)butan-2-yl]-1-ethyl-1H-pyrazole-5-carboxamide

Catalog ID
STK304322
SMILES CCn1ncc(c1C(=O)NC(C(C)(C)C)Cn1cccn1)Br

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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 C15H22BrN5O MW 368.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H22BrN5O/c1-5-21-13(11(16)9-18-21)14(22)19-12(15(2,3)4)10-20-8-6-7-17-20/h6-9,12H,5,10H2,1-4H3,(H,19,22)
InChIKey
XQYVIRZPUTVMFT-UHFFFAOYSA-N
Synonyms
1005617-10-6
1005617106
4bromoN(33dimethyl1(1Hpyrazol1yl)butan2yl)1ethyl1Hpyrazole5carboxamide
4BROMON(33DIMETHYL1PYRAZOL1YLBUTAN2YL)2ETHYLPYRAZOLE3CARBOXAMIDE
CCN1C(=C(C=N1)Br)C(=O)NC(CN2C=CC=N2)C(C)(C)C
InChI=1SC15H22BrN5Oc152113(11(16)91821)14(22)1912(15(23)4)10208671720h6912H510H214H3(H1922)
MFCD04042870
ZINC000002780649
ZINC000002780650

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Available files

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