Vitas-M small molecule compound
(3E)-3-{[5-(2-bromo-4-nitrophenyl)furan-2-yl]methylidene}-5-(4-methylphenyl)furan-2(3H)-one
Catalog ID
STK193120
SMILES Cc1ccc(cc1)C1=C/C(=C\c2ccc(o2)c2ccc(cc2Br)[N+](=O)[O-])/C(=O)O1
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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 C22H14BrNO5 MW 452.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14BrNO5/c1-13-2-4-14(5-3-13)21-11-15(22(25)29-21)10-17-7-9-20(28-17)18-8-6-16(24(26)27)12-19(18)23/h2-12H,1H3/b15-10+InChIKey
GITQTIQMZLTJAA-XNTDXEJSSA-NSynonyms
(3E)3((5(2BROMO4NITROPHENYL)FURAN2YL)METHYLIDENE)5(4METHYLPHENYL)FURAN2(3H)ONE
(3E)3((5(2bromo4nitrophenyl)furan2yl)methylidene)5(4methylphenyl)furan2one
(E)3((5(2bromo4nitrophenyl)furan2yl)methylene)5(ptolyl)furan2(3H)one
CC1=CC=C(C=C1)C2=CC(=CC3=CC=C(O3)C4=C(C=C(C=C4)(N+)(=O)(O))Br)C(=O)O2
Cc1ccc(cc1)C1=CC(=Cc2ccc(o2)c2ccc(cc2Br)(N+)(=O)(O))C(=O)O1
InChI=1SC22H14BrNO5c1132414(5313)211115(22(25)2921)10177920(2817)188616(24(26)27)1219(18)23h212H1H3b1510+
MFCD02379610
ZINC000009311312
ZINC09311312
ZINC9311312
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