Vitas-M small molecule compound
(3-methoxynaphthalen-2-yl){4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Catalog ID
STL378393
SMILES COc1cc2ccccc2cc1C(=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 C23H20F3N3O4 MW 459.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20F3N3O4/c1-33-21-13-16-5-3-2-4-15(16)12-18(21)22(30)28-10-8-27(9-11-28)19-7-6-17(23(24,25)26)14-20(19)29(31)32/h2-7,12-14H,8-11H2,1H3InChIKey
FZJKCMPDUFCPRP-UHFFFAOYSA-NSynonyms
(3methoxynaphthalen2yl)(4(2nitro4(trifluoromethyl)phenyl)piperazin1yl)methanone
COC1=CC2=CC=CC=C2C=C1C(=O)N3CCN(CC3)C4=C(C=C(C=C4)C(F)(F)F)(N+)(=O)(O)
COc1cc2ccccc2cc1C(=O)N1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C(F)(F)F
InChI=1SC23H20F3N3O4c133211316532415(16)1218(21)22(30)2810827(91128)197617(23(2425)26)1420(19)29(31)32h271214H811H21H3
MFCD02636979
ZINC000015799268
ZINC15799268
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