Vitas-M small molecule compound
1-(4-methoxyphenyl)-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}pyrrolidine-2,5-dione
Catalog ID
STK081716
SMILES COc1ccc(cc1)N1C(=O)CC(C1=O)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(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 C22H21F3N4O5 MW 478.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21F3N4O5/c1-34-16-5-3-15(4-6-16)28-20(30)13-19(21(28)31)27-10-8-26(9-11-27)17-7-2-14(22(23,24)25)12-18(17)29(32)33/h2-7,12,19H,8-11,13H2,1H3InChIKey
HGINQJYNCOMGSY-UHFFFAOYSA-NSynonyms
522637-73-61(4METHOXYPHENYL)3(4(2NITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)PYRROLIDINE25DIONE
522637736
COC1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCN(CC3)C4=C(C=C(C=C4)C(F)(F)F)(N+)(=O)(O)
COc1ccc(cc1)N1C(=O)CC(C1=O)N1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C(F)(F)F
InChI=1SC22H21F3N4O5c134165315(4616)2820(30)1319(21(28)31)2710826(91127)177214(22(2324)25)1218(17)29(32)33h271219H81113H21H3
MFCD03453749
STK081716
ZINC000018136823
ZINC000100129398
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