Vitas-M small molecule compound

4-(2,4-dinitrophenyl)-2-methyl-1-(phenylsulfonyl)piperazine

Catalog ID
STK148712
SMILES CC1CN(CCN1S(=O)(=O)c1ccccc1)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 C17H18N4O6S MW 406.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O6S/c1-13-12-18(16-8-7-14(20(22)23)11-17(16)21(24)25)9-10-19(13)28(26,27)15-5-3-2-4-6-15/h2-8,11,13H,9-10,12H2,1H3
InChIKey
AAENPMQHDYNLBS-UHFFFAOYSA-N
Synonyms

1(BENZENESULFONYL)4(24DINITROPHENYL)2METHYLPIPERAZINE
4(24DINITROPHENYL)2METHYL1(PHENYLSULFONYL)PIPERAZINE
CC1CN(CCN1S(=O)(=O)c1ccccc1)c1ccc(cc1(N+)(=O)(O))(N+)(=O)(O)
CC1CN(CCN1S(=O)(=O)C2=CC=CC=C2)C3=C(C=C(C=C3)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC17H18N4O6Sc1131218(168714(20(22)23)1117(16)21(24)25)91019(13)28(2627)155324615h281113H91012H21H3
MFCD02187777
ZINC000004083464
ZINC000004083466

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Available files

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