Vitas-M small molecule compound

4-bromo-N-cycloheptyl-1-methyl-1H-pyrazole-5-carboxamide

Catalog ID
STK315472
SMILES O=C(c1c(Br)cnn1C)NC1CCCCCC1

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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 C12H18BrN3O MW 300.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18BrN3O/c1-16-11(10(13)8-14-16)12(17)15-9-6-4-2-3-5-7-9/h8-9H,2-7H2,1H3,(H,15,17)
InChIKey
XAXDGZRKQQTUCS-UHFFFAOYSA-N
Synonyms
512827-32-6
(4BROMO1METHYLPYRAZOL5YL)NCYCLOHEPTYLCARBOXAMIDE
4bromoNcycloheptyl1methyl1Hpyrazole5carboxamide
4BROMONCYCLOHEPTYL2METHYLPYRAZOLE3CARBOXAMIDE
512827326
CN1C(=C(C=N1)Br)C(=O)NC2CCCCCC2
InChI=1SC12H18BrN3Oc11611(10(13)81416)12(17)1596423579h89H27H21H3(H1517)
MFCD01448411
ZINC000000483232
ZINC00483232
ZINC483232

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Available files

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