Vitas-M small molecule compound

ethyl 5-{2-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-2-oxoethoxy}-1,2-dimethyl-1H-indole-3-carboxylate

Catalog ID
STK553044
SMILES CCOC(=O)c1c(C)n(c2c1cc(OCC(=O)N/N=C/c1ccc(cc1)Br)cc2)C

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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 C22H22BrN3O4 MW 472.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22BrN3O4/c1-4-29-22(28)21-14(2)26(3)19-10-9-17(11-18(19)21)30-13-20(27)25-24-12-15-5-7-16(23)8-6-15/h5-12H,4,13H2,1-3H3,(H,25,27)/b24-12+
InChIKey
YAPFBHJDXWUWSP-WYMPLXKRSA-N
Synonyms

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(=O)NN=CC3=CC=C(C=C3)Br)C)C
CCOC(=O)c1c(C)n(c2c1cc(OCC(=O)NN=Cc1ccc(cc1)Br)cc2)C
ethyl5(2((2E)2((4bromophenyl)methylidene)hydrazinyl)2oxoethoxy)12dimethylindole3carboxylate
ethyl5(2((2E)2(4bromobenzylidene)hydrazinyl)2oxoethoxy)12dimethyl1Hindole3carboxylate
ethyl5(2(2(4bromobenzylidene)hydrazinyl)2oxoethoxy)12dimethyl1Hindole3carboxylate
InChI=1SC22H22BrN3O4c142922(28)2114(2)26(3)1910917(1118(19)21)301320(27)252412155716(23)8615h512H413H213H3(H2527)b2412+
MFCD03130688
ZINC000008741168
ZINC33911182

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Available files

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