Vitas-M small molecule compound
(4Z)-4-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-1-phenylpyrazolidine-3,5-dione
Catalog ID
STK370331
SMILES O=C1NN(C(=O)/C/1=C\c1cc2OCOc2cc1Cl)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 C17H11ClN2O4 MW 342.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11ClN2O4/c18-13-8-15-14(23-9-24-15)7-10(13)6-12-16(21)19-20(17(12)22)11-4-2-1-3-5-11/h1-8H,9H2,(H,19,21)/b12-6-InChIKey
AUZSPYBTAQYPEF-SDQBBNPISA-NSynonyms
(4Z)4((6chloro13benzodioxol5yl)methylidene)1phenylpyrazolidine35dione
C1OC2=C(O1)C=C(C(=C2)C=C3C(=O)NN(C3=O)C4=CC=CC=C4)Cl
InChI=1SC17H11ClN2O4c181381514(2392415)710(13)61216(21)1920(17(12)22)114213511h18H9H2(H1921)b126
MFCD01430502
O=C1NN(C(=O)C1=Cc1cc2OCOc2cc1Cl)c1ccccc1
ZINC000016102512
ZINC16102512
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