Vitas-M small molecule compound

5-bromo-N'-[(E)-{4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl}methylidene]-1-benzofuran-2-carbohydrazide

Catalog ID
STK198198
SMILES Brc1ccc2c(c1)cc(o2)C(=O)N/N=C/c1ccc(cc1)Oc1ccc(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 C23H13BrF3N3O5 MW 548.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13BrF3N3O5/c24-16-4-8-19-14(9-16)10-21(35-19)22(31)29-28-12-13-1-5-17(6-2-13)34-20-7-3-15(23(25,26)27)11-18(20)30(32)33/h1-12H,(H,29,31)/b28-12+
InChIKey
PAHMOZCQGFRHGX-KVSWJAHQSA-N
Synonyms

5BROMON((E)(4(2NITRO4(TRIFLUOROMETHYL)PHENOXY)PHENYL)METHYLIDENE)1BENZOFURAN2CARBOHYDRAZIDE
5bromoN((E)(4(2nitro4(trifluoromethyl)phenoxy)phenyl)methylideneamino)1benzofuran2carboxamide
Brc1ccc2c(c1)cc(o2)C(=O)NN=Cc1ccc(cc1)Oc1ccc(cc1(N+)(=O)(O))C(F)(F)F
C1=CC(=CC=C1C=NNC(=O)C2=CC3=C(O2)C=CC(=C3)Br)OC4=C(C=C(C=C4)C(F)(F)F)(N+)(=O)(O)
InChI=1SC23H13BrF3N3O5c2416481914(916)1021(3519)22(31)292812131517(6213)34207315(23(2526)27)1118(20)30(32)33h112H(H2931)b2812+
MFCD02602951
N((1E)2(4(2NITRO4(TRIFLUOROMETHYL)PHENOXY)PHENYL)1AZAVINYL)(5BROMOBENZO(D)FURAN2YL)CARBOXAMIDE
ZINC000100216436
ZINC101749273

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Available files

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