Vitas-M small molecule compound

(2-bromophenyl)[4-(2,4-dinitrophenyl)-2,6-dimethylpiperazin-1-yl]methanone

Catalog ID
STK017854
SMILES CC1CN(CC(N1C(=O)c1ccccc1Br)C)c1ccc(cc1[N+](=O)[O-])[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 C19H19BrN4O5 MW 463.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19BrN4O5/c1-12-10-21(17-8-7-14(23(26)27)9-18(17)24(28)29)11-13(2)22(12)19(25)15-5-3-4-6-16(15)20/h3-9,12-13H,10-11H2,1-2H3
InChIKey
OOGVANBLWPRPTC-UHFFFAOYSA-N
Synonyms

(2BROMOPHENYL)(4(24DINITROPHENYL)26DIMETHYLPIPERAZIN1YL)METHANONE
4(24DINITROPHENYL)26DIMETHYLPIPERAZINYL2BROMOPHENYLKETONE
CC1CN(CC(N1C(=O)c1ccccc1Br)C)c1ccc(cc1(N+)(=O)(O))(N+)(=O)(O)
CC1CN(CC(N1C(=O)C2=CC=CC=C2Br)C)C3=C(C=C(C=C3)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC19H19BrN4O5c1121021(178714(23(26)27)918(17)24(28)29)1113(2)22(12)19(25)15534616(15)20h391213H1011H212H3
MFCD01173857
STK017854
ZINC000008984996
ZINC000100557468

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Available files

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