Vitas-M small molecule compound

(4-bromothiophen-2-yl)[4-(3-methoxyphenyl)piperazin-1-yl]methanone

Catalog ID
STK484668
SMILES COc1cccc(c1)N1CCN(CC1)C(=O)c1scc(c1)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 C16H17BrN2O2S MW 381.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17BrN2O2S/c1-21-14-4-2-3-13(10-14)18-5-7-19(8-6-18)16(20)15-9-12(17)11-22-15/h2-4,9-11H,5-8H2,1H3
InChIKey
VFQSDSICCCFSDX-UHFFFAOYSA-N
Synonyms

(4bromothiophen2yl)(4(3methoxyphenyl)piperazin1yl)methanone
COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3=CC(=CS3)Br
InChI=1SC16H17BrN2O2Sc1211442313(1014)185719(8618)16(20)15912(17)112215h24911H58H21H3
MFCD08724896
ZINC000013326206
ZINC13326206

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Available files

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