Vitas-M small molecule compound

1-(4-methoxy-2-nitrophenyl)-4-(phenylsulfonyl)piperazine

Catalog ID
STK155433
SMILES COc1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)S(=O)(=O)c1ccccc1

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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 C17H19N3O5S MW 377.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O5S/c1-25-14-7-8-16(17(13-14)20(21)22)18-9-11-19(12-10-18)26(23,24)15-5-3-2-4-6-15/h2-8,13H,9-12H2,1H3
InChIKey
WUMZPPSCGGGOBZ-UHFFFAOYSA-N
Synonyms

1(4METHOXY2NITROPHENYL)4(PHENYLSULFONYL)PIPERAZINE
1(BENZENESULFONYL)4(4METHOXY2NITROPHENYL)PIPERAZINE
COC1=CC(=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))N1CCN(CC1)S(=O)(=O)c1ccccc1
InChI=1SC17H19N3O5Sc125147816(17(1314)20(21)22)1891119(121018)26(2324)155324615h2813H912H21H3
MFCD03906524
ZINC000004688039
ZINC04688039
ZINC4688039

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Available files

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