Vitas-M small molecule compound
4-(2,5-dimethyl-3-{(E)-[2-(naphtho[2,1-b]furan-2-ylcarbonyl)hydrazinylidene]methyl}-1H-pyrrol-1-yl)benzoic acid
Catalog ID
STK056486
SMILES O=C(c1oc2c(c1)c1ccccc1cc2)N/N=C/c1cc(n(c1C)c1ccc(cc1)C(=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 C27H21N3O4 MW 451.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O4/c1-16-13-20(17(2)30(16)21-10-7-19(8-11-21)27(32)33)15-28-29-26(31)25-14-23-22-6-4-3-5-18(22)9-12-24(23)34-25/h3-15H,1-2H3,(H,29,31)(H,32,33)/b28-15+InChIKey
VEHCJXXXQGBSHB-RWPZCVJISA-NSynonyms
4(25DIMETHYL3((E)(2(NAPHTHO(21B)FURAN2YLCARBONYL)HYDRAZINYLIDENE)METHYL)1HPYRROL1YL)BENZOICACID
4(3((E)(benzo(e)(1)benzofuran2carbonylhydrazinylidene)methyl)25dimethylpyrrol1yl)benzoicacid
CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)O)C)C=NNC(=O)C3=CC4=C(O3)C=CC5=CC=CC=C54
InChI=1SC27H21N3O4c1161320(17(2)30(16)2110719(81121)27(32)33)15282926(31)25142322643518(22)91224(23)3425h315H12H3(H2931)(H3233)b2815+
MFCD02953776
O=C(c1oc2c(c1)c1ccccc1cc2)NN=Cc1cc(n(c1C)c1ccc(cc1)C(=O)O)C
STK056486
ZINC000009514066
ZINC96471062
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