Vitas-M small molecule compound

1-methyl-4-{2-nitro-5-[4-(phenylsulfonyl)piperazin-1-yl]phenyl}piperazine

Catalog ID
STK148958
SMILES CN1CCN(CC1)c1cc(ccc1[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 C21H27N5O4S MW 445.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O4S/c1-22-9-11-24(12-10-22)21-17-18(7-8-20(21)26(27)28)23-13-15-25(16-14-23)31(29,30)19-5-3-2-4-6-19/h2-8,17H,9-16H2,1H3
InChIKey
IHEUTERGJCQAHB-UHFFFAOYSA-N
Synonyms

1(5(4(BENZENESULFONYL)PIPERAZIN1YL)2NITROPHENYL)4METHYLPIPERAZINE
1METHYL4(2NITRO5(4(PHENYLSULFONYL)PIPERAZIN1YL)PHENYL)PIPERAZINE
CN1CCN(CC1)c1cc(ccc1(N+)(=O)(O))N1CCN(CC1)S(=O)(=O)c1ccccc1
CN1CCN(CC1)C2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)(N+)(=O)(O)
InChI=1SC21H27N5O4Sc12291124(121022)211718(7820(21)26(27)28)23131525(161423)31(2930)195324619h2817H916H21H3
MFCD02632032
ZINC000004143613
ZINC4143613

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Available files

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