Vitas-M small molecule compound
(4Z)-4-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-(4-chloro-3-nitrophenyl)-1,3-oxazol-5(4H)-one
Catalog ID
STK838325
SMILES O=C1OC(=N/C/1=C\c1cc2OCOc2cc1Br)c1ccc(c(c1)[N+](=O)[O-])Cl
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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 C17H8BrClN2O6 MW 451.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H8BrClN2O6/c18-10-6-15-14(25-7-26-15)5-9(10)3-12-17(22)27-16(20-12)8-1-2-11(19)13(4-8)21(23)24/h1-6H,7H2/b12-3-InChIKey
XFZZBZDWAJYXHB-BASWHVEKSA-NSynonyms
5891-34-9(4Z)4((6bromo13benzodioxol5yl)methylidene)2(4chloro3nitrophenyl)13oxazol5(4H)one
(4Z)4((6BROMO13BENZODIOXOL5YL)METHYLIDENE)2(4CHLORO3NITROPHENYL)13OXAZOL5ONE
(Z)4((6bromobenzo(d)(13)dioxol5yl)methylene)2(4chloro3nitrophenyl)oxazol5(4H)one
4((6BROMO(2HBENZO(D)13DIOXOLAN5YL))METHYLENE)2(4CHLORO3NITROPHENYL)13OXAZOLIN5ONE
5891349
C1OC2=C(O1)C=C(C(=C2)C=C3C(=O)OC(=N3)C4=CC(=C(C=C4)Cl)(N+)(=O)(O))Br
InChI=1SC17H8BrClN2O6c181061514(2572615)59(10)31217(22)2716(2012)81211(19)13(48)21(23)24h16H7H2b123
MFCD00621256
O=C1OC(=NC1=Cc1cc2OCOc2cc1Br)c1ccc(c(c1)(N+)(=O)(O))Cl
ZINC000008935116
ZINC08935116
ZINC8935116
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