Vitas-M small molecule compound

3-bromo-N'-{(E)-[4-(2,4-dinitrophenoxy)-3-ethoxyphenyl]methylidene}benzohydrazide

Catalog ID
STK256124
SMILES CCOc1cc(/C=N/NC(=O)c2cccc(c2)Br)ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

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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 C22H17BrN4O7 MW 529.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrN4O7/c1-2-33-21-10-14(13-24-25-22(28)15-4-3-5-16(23)11-15)6-8-20(21)34-19-9-7-17(26(29)30)12-18(19)27(31)32/h3-13H,2H2,1H3,(H,25,28)/b24-13+
InChIKey
ZPTVYTPMNVLKSK-ZMOGYAJESA-N
Synonyms

3bromoN((E)(4(24dinitrophenoxy)3ethoxyphenyl)methylidene)benzohydrazide
3bromoN((E)(4(24dinitrophenoxy)3ethoxyphenyl)methylideneamino)benzamide
CCOC1=C(C=CC(=C1)C=NNC(=O)C2=CC(=CC=C2)Br)OC3=C(C=C(C=C3)(N+)(=O)(O))(N+)(=O)(O)
CCOc1cc(C=NNC(=O)c2cccc(c2)Br)ccc1Oc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC22H17BrN4O7c1233211014(13242522(28)1543516(23)1115)6820(21)34199717(26(29)30)1218(19)27(31)32h313H2H21H3(H2528)b2413+
MFCD01979296
ZINC000100225434
ZINC100225432

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Available files

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