Vitas-M small molecule compound

(4-benzylpiperidin-1-yl)(4-bromo-1-methyl-1H-pyrazol-3-yl)methanone

Catalog ID
STK760606
SMILES Cn1cc(c(n1)C(=O)N1CCC(CC1)Cc1ccccc1)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 C17H20BrN3O MW 362.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20BrN3O/c1-20-12-15(18)16(19-20)17(22)21-9-7-14(8-10-21)11-13-5-3-2-4-6-13/h2-6,12,14H,7-11H2,1H3
InChIKey
UPKJAKIRUGUUHW-UHFFFAOYSA-N
Synonyms

(4BENZYLPIPERIDIN1YL)(4BROMO1METHYL1HPYRAZOL3YL)METHANONE
(4BENZYLPIPERIDIN1YL)(4BROMO1METHYLPYRAZOL3YL)METHANONE
4BROMO1METHYLPYRAZOL3YL4BENZYLPIPERIDYLKETONE
CN1C=C(C(=N1)C(=O)N2CCC(CC2)CC3=CC=CC=C3)Br
InChI=1SC17H20BrN3Oc1201215(18)16(1920)17(22)219714(81021)11135324613h261214H711H21H3
MFCD01449584
ZINC000001064179
ZINC01064179
ZINC1064179

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Available files

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