Vitas-M small molecule compound
ethyl 4-[(4Z)-4-(5-chloro-2-hydroxy-3-methoxybenzylidene)-3,5-dioxopyrazolidin-1-yl]benzoate
Catalog ID
STK093232
SMILES CCOC(=O)c1ccc(cc1)N1NC(=O)/C(=C/c2cc(Cl)cc(c2O)OC)/C1=O
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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 C20H17ClN2O6 MW 416.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN2O6/c1-3-29-20(27)11-4-6-14(7-5-11)23-19(26)15(18(25)22-23)9-12-8-13(21)10-16(28-2)17(12)24/h4-10,24H,3H2,1-2H3,(H,22,25)/b15-9-InChIKey
RIMMUIYBEJYZPM-DHDCSXOGSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=CC(=C3O)OC)Cl)C(=O)N2
CCOC(=O)c1ccc(cc1)N1NC(=O)C(=Cc2cc(Cl)cc(c2O)OC)C1=O
ETHYL4((4Z)4((5CHLORO2HYDROXY3METHOXYPHENYL)METHYLIDENE)35DIOXOPYRAZOLIDIN1YL)BENZOATE
ETHYL4((4Z)4(5CHLORO2HYDROXY3METHOXYBENZYLIDENE)35DIOXOPYRAZOLIDIN1YL)BENZOATE
InChI=1SC20H17ClN2O6c132920(27)114614(7511)2319(26)15(18(25)2223)912813(21)1016(282)17(12)24h41024H3H212H3(H2225)b159
MFCD03142278
STK093232
ZINC04675192
ZINC4675192
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