Vitas-M small molecule compound
1-[2,6-dinitro-4-(trifluoromethyl)phenyl]-4-(methylsulfonyl)piperazine
Catalog ID
STK148846
SMILES FC(c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])N1CCN(CC1)S(=O)(=O)C)(F)F
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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 C12H13F3N4O6S MW 398.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13F3N4O6S/c1-26(24,25)17-4-2-16(3-5-17)11-9(18(20)21)6-8(12(13,14)15)7-10(11)19(22)23/h6-7H,2-5H2,1H3InChIKey
JRQQXOSKDPAGRG-UHFFFAOYSA-NSynonyms
1(26DINITRO4(TRIFLUOROMETHYL)PHENYL)4(METHYLSULFONYL)PIPERAZINE
1(26DINITRO4(TRIFLUOROMETHYL)PHENYL)4METHYLSULFONYLPIPERAZINE
1(26DINITRO4TRIFLUOROMETHYLPHENYL)4METHANESULFONYLPIPERAZINE
4(26DINITRO4(TRIFLUOROMETHYL)PHENYL)1(METHYLSULFONYL)PIPERAZINE
CS(=O)(=O)N1CCN(CC1)C2=C(C=C(C=C2(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O)
FC(c1cc((N+)(=O)(O))c(c(c1)(N+)(=O)(O))N1CCN(CC1)S(=O)(=O)C)(F)F
InChI=1SC12H13F3N4O6Sc126(2425)174216(3517)119(18(20)21)68(12(1314)15)710(11)19(22)23h67H25H21H3
MFCD02629921
ZINC000008856755
ZINC08856755
ZINC8856755
Check stock
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Check stock on Vitas-MAvailable files
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