Vitas-M small molecule compound
3-{(Z)-[1-(4-fluorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}phenyl acetate
Catalog ID
STL444648
SMILES CC(=O)Oc1cccc(c1)/C=C\1/C(=O)NN(C1=O)c1ccc(cc1)F
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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 C18H13FN2O4 MW 340.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13FN2O4/c1-11(22)25-15-4-2-3-12(9-15)10-16-17(23)20-21(18(16)24)14-7-5-13(19)6-8-14/h2-10H,1H3,(H,20,23)/b16-10-InChIKey
UXDJUMYNWZJWQQ-YBEGLDIGSA-NSynonyms
(3((Z)(1(4FLUOROPHENYL)35DIOXOPYRAZOLIDIN4YLIDENE)METHYL)PHENYL)ACETATE
3((Z)(1(4fluorophenyl)35dioxopyrazolidin4ylidene)methyl)phenylacetate
CC(=O)OC1=CC=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=C(C=C3)F
CC(=O)Oc1cccc(c1)C=C1C(=O)NN(C1=O)c1ccc(cc1)F
InChI=1SC18H13FN2O4c111(22)251542312(915)101617(23)2021(18(16)24)147513(19)6814h210H1H3(H2023)b1610
MFCD03079321
ZINC000016182924
ZINC16182924
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