Vitas-M small molecule compound

(2-bromophenyl){4-[4-nitro-3-(pyrrolidin-1-yl)phenyl]piperazin-1-yl}methanone

Catalog ID
STK172402
SMILES Brc1ccccc1C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCCC1)[N+](=O)[O-]

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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 C21H23BrN4O3 MW 459.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23BrN4O3/c22-18-6-2-1-5-17(18)21(27)25-13-11-23(12-14-25)16-7-8-19(26(28)29)20(15-16)24-9-3-4-10-24/h1-2,5-8,15H,3-4,9-14H2
InChIKey
CEESHOSQNVDLTA-UHFFFAOYSA-N
Synonyms

(2BROMOPHENYL)(4(4NITRO3(PYRROLIDIN1YL)PHENYL)PIPERAZIN1YL)METHANONE
(2BROMOPHENYL)(4(4NITRO3PYRROLIDIN1YLPHENYL)PIPERAZIN1YL)METHANONE
Brc1ccccc1C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCCC1)(N+)(=O)(O)
C1CCN(C1)C2=C(C=CC(=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4Br)(N+)(=O)(O)
InChI=1SC21H23BrN4O3c2218621517(18)21(27)25131123(121425)167819(26(28)29)20(1516)249341024h125815H34914H2
MFCD04219428
ZINC000009891984
ZINC09891984
ZINC9891984

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Available files

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