Vitas-M small molecule compound
methyl 4-(3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}-2,5-dioxopyrrolidin-1-yl)benzoate
Catalog ID
STK019214
SMILES COC(=O)c1ccc(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 C23H21F3N4O6 MW 506.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21F3N4O6/c1-36-22(33)14-2-5-16(6-3-14)29-20(31)13-19(21(29)32)28-10-8-27(9-11-28)17-7-4-15(23(24,25)26)12-18(17)30(34)35/h2-7,12,19H,8-11,13H2,1H3InChIKey
UNDHOTWVTLTSNV-UHFFFAOYSA-NSynonyms
522637-77-0522637770
COC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCN(CC3)C4=C(C=C(C=C4)C(F)(F)F)(N+)(=O)(O)
COC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)N1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C(F)(F)F
InChI=1SC23H21F3N4O6c13622(33)142516(6314)2920(31)1319(21(29)32)2810827(91128)177415(23(2425)26)1218(17)30(34)35h271219H81113H21H3
METHYL4(3(4(2NITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)25DIOXOPYRROLIDIN1YL)BENZOATE
MFCD03487273
STK019214
ZINC000018276806
ZINC000100129418
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