Vitas-M small molecule compound
(4Z)-1-(4-bromophenyl)-4-[4-(diethylamino)-3-nitrobenzylidene]pyrazolidine-3,5-dione
Catalog ID
STL431005
SMILES CCN(c1ccc(cc1[N+](=O)[O-])/C=C\1/C(=O)NN(C1=O)c1ccc(cc1)Br)CC
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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 C20H19BrN4O4 MW 459.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrN4O4/c1-3-23(4-2)17-10-5-13(12-18(17)25(28)29)11-16-19(26)22-24(20(16)27)15-8-6-14(21)7-9-15/h5-12H,3-4H2,1-2H3,(H,22,26)/b16-11-InChIKey
KUQRFRPHGQHUSG-WJDWOHSUSA-NSynonyms
(4Z)1(4bromophenyl)4((4(diethylamino)3nitrophenyl)methylidene)pyrazolidine35dione
(4Z)1(4bromophenyl)4(4(diethylamino)3nitrobenzylidene)pyrazolidine35dione
CCN(c1ccc(cc1(N+)(=O)(O))C=C1C(=O)NN(C1=O)c1ccc(cc1)Br)CC
CCN(CC)C1=C(C=C(C=C1)C=C2C(=O)NN(C2=O)C3=CC=C(C=C3)Br)(N+)(=O)(O)
InChI=1SC20H19BrN4O4c1323(42)1710513(1218(17)25(28)29)111619(26)2224(20(16)27)158614(21)7915h512H34H212H3(H2226)b1611
MFCD01446240
ZINC000032109799
ZINC32109799
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