Vitas-M small molecule compound
(4E)-4-[(3,5-dimethyl-1H-pyrazol-4-yl)(hydroxy)methylidene]-1-[3-(morpholin-4-yl)propyl]-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Catalog ID
STK646872
SMILES O=C1C(=O)N(C(/C/1=C(/c1c(C)n[nH]c1C)\O)c1cccnc1)CCCN1CCOCC1
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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 C22H27N5O4 MW 425.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5O4/c1-14-17(15(2)25-24-14)20(28)18-19(16-5-3-6-23-13-16)27(22(30)21(18)29)8-4-7-26-9-11-31-12-10-26/h3,5-6,13,19,28H,4,7-12H2,1-2H3,(H,24,25)/b20-18+InChIKey
NPWPUTIDUINSLN-CZIZESTLSA-NSynonyms
1187337-26-3(4E)4((35dimethyl1Hpyrazol4yl)(hydroxy)methylidene)1(3(morpholin4yl)propyl)5(pyridin3yl)pyrrolidine23dione
(4E)4((35dimethyl1Hpyrazol4yl)hydroxymethylidene)1(3morpholin4ylpropyl)5pyridin3ylpyrrolidine23dione
1187337263
CC1=C(C(=NN1)C)C(=C2C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CN=CC=C4)O
InChI=1SC22H27N5O4c11417(15(2)252414)20(28)1819(16536231316)27(22(30)21(18)29)8472691131121026h356131928H4712H212H3(H2425)b2018+
MFCD18164386
O=C1C(=O)N(C(C1=C(c1c(C)n(nH)c1C)O)c1cccnc1)CCCN1CCOCC1
ZINC000102753177
ZINC000102753179
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