Vitas-M small molecule compound
(4E)-4-(4-bromo-3-nitrobenzylidene)-1-(3,4-dimethylphenyl)pyrazolidine-3,5-dione
Catalog ID
STK376998
SMILES O=C1NN(C(=O)/C/1=C/c1ccc(c(c1)[N+](=O)[O-])Br)c1ccc(c(c1)C)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 C18H14BrN3O4 MW 416.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14BrN3O4/c1-10-3-5-13(7-11(10)2)21-18(24)14(17(23)20-21)8-12-4-6-15(19)16(9-12)22(25)26/h3-9H,1-2H3,(H,20,23)/b14-8+InChIKey
YEFHOSARJKQBJJ-RIYZIHGNSA-NSynonyms
(4E)4((4BROMO3NITROPHENYL)METHYLIDENE)1(34DIMETHYLPHENYL)PYRAZOLIDINE35DIONE
(4E)4(4bromo3nitrobenzylidene)1(34dimethylphenyl)pyrazolidine35dione
1(34DIMETHYLPHENYL)4((4BROMO3NITROPHENYL)METHYLENE)12DIAZOLIDINE35DIONE
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)Br)(N+)(=O)(O))C(=O)N2)C
InChI=1SC18H14BrN3O4c1103513(711(10)2)2118(24)14(17(23)2021)8124615(19)16(912)22(25)26h39H12H3(H2023)b148+
MFCD00821760
O=C1NN(C(=O)C1=Cc1ccc(c(c1)(N+)(=O)(O))Br)c1ccc(c(c1)C)C
ZINC000001055752
ZINC01055752
ZINC1055752
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