Vitas-M small molecule compound
2-{2-bromo-4-[(E)-2-cyano-2-(4-nitrophenyl)ethenyl]phenoxy}-N-(4-methoxyphenyl)acetamide
Catalog ID
STL484790
SMILES COc1ccc(cc1)NC(=O)COc1ccc(cc1Br)/C=C(\c1ccc(cc1)[N+](=O)[O-])/C#N
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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 C24H18BrN3O5 MW 508.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18BrN3O5/c1-32-21-9-5-19(6-10-21)27-24(29)15-33-23-11-2-16(13-22(23)25)12-18(14-26)17-3-7-20(8-4-17)28(30)31/h2-13H,15H2,1H3,(H,27,29)/b18-12-InChIKey
NTHPFTJAMVFVJD-PDGQHHTCSA-NSynonyms
2(2bromo4((E)2cyano2(4nitrophenyl)ethenyl)phenoxy)N(4methoxyphenyl)acetamide
COC1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C=C(C#N)C3=CC=C(C=C3)(N+)(=O)(O))Br
COc1ccc(cc1)NC(=O)COc1ccc(cc1Br)C=C(c1ccc(cc1)(N+)(=O)(O))C#N
InChI=1SC24H18BrN3O5c132219519(61021)2724(29)15332311216(1322(23)25)1218(1426)173720(8417)28(30)31h213H15H21H3(H2729)b1812
MFCD30713717
ZINC000033475864
ZINC33475864
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