Vitas-M small molecule compound
(2-methoxy-3-methylphenyl){4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Catalog ID
STK347316
SMILES COc1c(C)cccc1C(=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 C20H20F3N3O4 MW 423.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20F3N3O4/c1-13-4-3-5-15(18(13)30-2)19(27)25-10-8-24(9-11-25)16-7-6-14(20(21,22)23)12-17(16)26(28)29/h3-7,12H,8-11H2,1-2H3InChIKey
YIVBFUHPGJZRAR-UHFFFAOYSA-NSynonyms
(2methoxy3methylphenyl)(4(2nitro4(trifluoromethyl)phenyl)piperazin1yl)methanone
CC1=CC=CC(=C1OC)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)(N+)(=O)(O)
COc1c(C)cccc1C(=O)N1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C(F)(F)F
InChI=1SC20H20F3N3O4c11343515(18(13)302)19(27)2510824(91125)167614(20(2122)23)1217(16)26(28)29h3712H811H212H3
MFCD06629942
ZINC000012860770
ZINC12860770
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