Vitas-M small molecule compound
(4E)-4-{2-[2-(2-chlorophenoxy)ethoxy]-5-nitrobenzylidene}-1-phenylpyrazolidine-3,5-dione
Catalog ID
STK089433
SMILES O=C1NN(C(=O)/C/1=C/c1cc(ccc1OCCOc1ccccc1Cl)[N+](=O)[O-])c1ccccc1
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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 C24H18ClN3O6 MW 479.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18ClN3O6/c25-20-8-4-5-9-22(20)34-13-12-33-21-11-10-18(28(31)32)14-16(21)15-19-23(29)26-27(24(19)30)17-6-2-1-3-7-17/h1-11,14-15H,12-13H2,(H,26,29)/b19-15+InChIKey
RTTQPVPZDAMDPG-XDJHFCHBSA-NSynonyms
(4E)4((2(2(2CHLOROPHENOXY)ETHOXY)5NITROPHENYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4E)4(2(2(2CHLOROPHENOXY)ETHOXY)5NITROBENZYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=CC(=C3)(N+)(=O)(O))OCCOC4=CC=CC=C4Cl)C(=O)N2
InChI=1SC24H18ClN3O6c2520845922(20)3413123321111018(28(31)32)1416(21)151923(29)2627(24(19)30)176213717h1111415H1213H2(H2629)b1915+
MFCD02923497
O=C1NN(C(=O)C1=Cc1cc(ccc1OCCOc1ccccc1Cl)(N+)(=O)(O))c1ccccc1
STK089433
ZINC000013894390
ZINC13894390
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