Vitas-M small molecule compound
(4E)-4-[(3,5-dimethyl-1H-pyrazol-4-yl)(hydroxy)methylidene]-5-(3-fluorophenyl)-1-[3-(morpholin-4-yl)propyl]pyrrolidine-2,3-dione
Catalog ID
STK645534
SMILES Fc1cccc(c1)C1N(CCCN2CCOCC2)C(=O)C(=O)/C/1=C(\c1c(C)n[nH]c1C)/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 C23H27FN4O4 MW 442.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27FN4O4/c1-14-18(15(2)26-25-14)21(29)19-20(16-5-3-6-17(24)13-16)28(23(31)22(19)30)8-4-7-27-9-11-32-12-10-27/h3,5-6,13,20,29H,4,7-12H2,1-2H3,(H,25,26)/b21-19+InChIKey
ZETOWEXRFHRACD-XUTLUUPISA-NSynonyms
1238865-33-2(4E)4((35dimethyl1Hpyrazol4yl)(hydroxy)methylidene)5(3fluorophenyl)1(3(morpholin4yl)propyl)pyrrolidine23dione
(4E)4((35dimethyl1Hpyrazol4yl)hydroxymethylidene)5(3fluorophenyl)1(3morpholin4ylpropyl)pyrrolidine23dione
1238865332
CC1=C(C(=NN1)C)C(=C2C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CC(=CC=C4)F)O
Fc1cccc(c1)C1N(CCCN2CCOCC2)C(=O)C(=O)C1=C(c1c(C)n(nH)c1C)O
InChI=1SC23H27FN4O4c11418(15(2)262514)21(29)1920(1653617(24)1316)28(23(31)22(19)30)8472791132121027h356132029H4712H212H3(H2526)b2119+
MFCD18163952
ZINC000102751775
ZINC000102751777
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