Vitas-M small molecule compound

4-(2-chloro-4-nitrophenyl)-2-methyl-1-(methylsulfonyl)piperazine

Catalog ID
STK148643
SMILES CC1CN(CCN1S(=O)(=O)C)c1ccc(cc1Cl)[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 C12H16ClN3O4S MW 333.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16ClN3O4S/c1-9-8-14(5-6-15(9)21(2,19)20)12-4-3-10(16(17)18)7-11(12)13/h3-4,7,9H,5-6,8H2,1-2H3
InChIKey
YGCSFYWXSMBDES-UHFFFAOYSA-N
Synonyms

4(2CHLORO4NITROPHENYL)1METHANESULFONYL2METHYLPIPERAZINE
4(2CHLORO4NITROPHENYL)2METHYL1(METHYLSULFONYL)PIPERAZINE
4(2CHLORO4NITROPHENYL)2METHYL1METHYLSULFONYLPIPERAZINE
CC1CN(CCN1S(=O)(=O)C)c1ccc(cc1Cl)(N+)(=O)(O)
CC1CN(CCN1S(=O)(=O)C)C2=C(C=C(C=C2)(N+)(=O)(O))Cl
InChI=1SC12H16ClN3O4Sc19814(5615(9)21(219)20)124310(16(17)18)711(12)13h3479H568H212H3
MFCD02216867
ZINC000004117554
ZINC000004117555

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Available files

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