Vitas-M small molecule compound
1-[(3,4-dimethoxyphenyl)sulfonyl]-4-[4-nitro-3-(pyrrolidin-1-yl)phenyl]piperazine
Catalog ID
STK205841
SMILES COc1ccc(cc1OC)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)N1CCCC1)[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 C22H28N4O6S MW 476.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O6S/c1-31-21-8-6-18(16-22(21)32-2)33(29,30)25-13-11-23(12-14-25)17-5-7-19(26(27)28)20(15-17)24-9-3-4-10-24/h5-8,15-16H,3-4,9-14H2,1-2H3InChIKey
LVTFJXMRTGJBAO-UHFFFAOYSA-NSynonyms
1((34DIMETHOXYPHENYL)SULFONYL)4(4NITRO3(PYRROLIDIN1YL)PHENYL)PIPERAZINE
1(34DIMETHOXYPHENYL)SULFONYL4(4NITRO3PYRROLIDIN1YLPHENYL)PIPERAZINE
COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4CCCC4)OC
COc1ccc(cc1OC)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)N1CCCC1)(N+)(=O)(O)
InChI=1SC22H28N4O6Sc131218618(1622(21)322)33(2930)25131123(121425)175719(26(27)28)20(1517)249341024h581516H34914H212H3
MFCD05826451
ZINC000009971645
ZINC09971645
ZINC9971645
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