Vitas-M small molecule compound
(4Z)-1-(3-bromophenyl)-4-{[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methylidene}pyrazolidine-3,5-dione
Catalog ID
STK544977
SMILES COc1ccc(c(c1)[N+](=O)[O-])c1ccc(o1)/C=C\1/C(=O)NN(C1=O)c1cccc(c1)Br
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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 C21H14BrN3O6 MW 484.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14BrN3O6/c1-30-14-5-7-16(18(11-14)25(28)29)19-8-6-15(31-19)10-17-20(26)23-24(21(17)27)13-4-2-3-12(22)9-13/h2-11H,1H3,(H,23,26)/b17-10-InChIKey
RQPBIINIULGMNG-YVLHZVERSA-NSynonyms
(4Z)1(3bromophenyl)4((5(4methoxy2nitrophenyl)furan2yl)methylidene)pyrazolidine35dione
(Z)1(3bromophenyl)4((5(4methoxy2nitrophenyl)furan2yl)methylene)pyrazolidine35dione
COC1=CC(=C(C=C1)C2=CC=C(O2)C=C3C(=O)NN(C3=O)C4=CC(=CC=C4)Br)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))c1ccc(o1)C=C1C(=O)NN(C1=O)c1cccc(c1)Br
InChI=1SC21H14BrN3O6c130145716(18(1114)25(28)29)198615(3119)101720(26)2324(21(17)27)1342312(22)913h211H1H3(H2326)b1710
MFCD01158282
ZINC000002355245
ZINC02355245
ZINC2355245
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