Vitas-M small molecule compound
5-bromo-N'-{(E)-[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-1-benzofuran-2-carbohydrazide
Catalog ID
STK198182
SMILES Brc1ccc2c(c1)cc(o2)C(=O)N/N=C/c1cc(n(c1C)c1cccc(c1)[N+](=O)[O-])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 C22H17BrN4O4 MW 481.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrN4O4/c1-13-8-16(14(2)26(13)18-4-3-5-19(11-18)27(29)30)12-24-25-22(28)21-10-15-9-17(23)6-7-20(15)31-21/h3-12H,1-2H3,(H,25,28)/b24-12+InChIKey
BKACWUUVISXIBD-WYMPLXKRSA-NSynonyms
(E)5bromoN((25dimethyl1(3nitrophenyl)1Hpyrrol3yl)methylene)benzofuran2carbohydrazide
5BROMON((E)(25DIMETHYL1(3NITROPHENYL)1HPYRROL3YL)METHYLIDENE)1BENZOFURAN2CARBOHYDRAZIDE
5BROMON((E)(25DIMETHYL1(3NITROPHENYL)PYRROL3YL)METHYLIDENEAMINO)1BENZOFURAN2CARBOXAMIDE
Brc1ccc2c(c1)cc(o2)C(=O)NN=Cc1cc(n(c1C)c1cccc(c1)(N+)(=O)(O))C
CC1=CC(=C(N1C2=CC(=CC=C2)(N+)(=O)(O))C)C=NNC(=O)C3=CC4=C(O3)C=CC(=C4)Br
InChI=1SC22H17BrN4O4c113816(14(2)26(13)1843519(1118)27(29)30)12242522(28)211015917(23)6720(15)3121h312H12H3(H2528)b2412+
MFCD02602824
ZINC000002301791
ZINC33352534
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