Vitas-M small molecule compound
7-bromo-9a-ethoxy-3-(3-nitrophenyl)[1,2,4]oxadiazolo[4,5-a]indol-9(9aH)-one
Catalog ID
STK784836
SMILES CCOC12ON=C(N1c1c(C2=O)cc(cc1)Br)c1cccc(c1)[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 C17H12BrN3O5 MW 418.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12BrN3O5/c1-2-25-17-15(22)13-9-11(18)6-7-14(13)20(17)16(19-26-17)10-4-3-5-12(8-10)21(23)24/h3-9H,2H2,1H3InChIKey
ZFDNBMSIXWFZSM-UHFFFAOYSA-NSynonyms
6BROMO3AETHOXY1(3NITROPHENYL)(124)OXADIAZOLO(45A)INDOL4ONE
7bromo9aethoxy3(3nitrophenyl)(124)oxadiazolo(45a)indol9(9aH)one
CCOC12C(=O)C3=C(N1C(=NO2)C4=CC(=CC=C4)(N+)(=O)(O))C=CC(=C3)Br
CCOC12ON=C(N1c1c(C2=O)cc(cc1)Br)c1cccc(c1)(N+)(=O)(O)
InChI=1SC17H12BrN3O5c12251715(22)13911(18)6714(13)20(17)16(192617)1043512(810)21(23)24h39H2H21H3
MFCD07657184
ZINC000012411229
ZINC000012411231
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