Vitas-M small molecule compound
[4-(2-bromobenzyl)piperazin-1-yl]{4-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}methanone
Catalog ID
STK308478
SMILES O=C(c1ccc(cc1)Cn1ncc(c1)[N+](=O)[O-])N1CCN(CC1)Cc1ccccc1Br
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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 C22H22BrN5O3 MW 484.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22BrN5O3/c23-21-4-2-1-3-19(21)15-25-9-11-26(12-10-25)22(29)18-7-5-17(6-8-18)14-27-16-20(13-24-27)28(30)31/h1-8,13,16H,9-12,14-15H2InChIKey
ZDIXAKYRAGGCNI-UHFFFAOYSA-NSynonyms
1005587-60-9(4((2BROMOPHENYL)METHYL)PIPERAZIN1YL)(4((4NITROPYRAZOL1YL)METHYL)PHENYL)METHANONE
(4(2bromobenzyl)piperazin1yl)(4((4nitro1Hpyrazol1yl)methyl)phenyl)methanone
1005587609
C1CN(CCN1CC2=CC=CC=C2Br)C(=O)C3=CC=C(C=C3)CN4C=C(C=N4)(N+)(=O)(O)
InChI=1SC22H22BrN5O3c2321421319(21)152591126(121025)22(29)187517(6818)14271620(132427)28(30)31h181316H9121415H2
MFCD04132279
O=C(c1ccc(cc1)Cn1ncc(c1)(N+)(=O)(O))N1CCN(CC1)Cc1ccccc1Br
ZINC000020028675
ZINC20028675
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