Vitas-M small molecule compound
(4E)-4-[(3,5-dimethyl-1H-pyrazol-4-yl)(hydroxy)methylidene]-5-(4-methoxyphenyl)-1-[2-(morpholin-4-yl)ethyl]pyrrolidine-2,3-dione
Catalog ID
STK639731
SMILES COc1ccc(cc1)C1N(CCN2CCOCC2)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 C23H28N4O5 MW 440.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O5/c1-14-18(15(2)25-24-14)21(28)19-20(16-4-6-17(31-3)7-5-16)27(23(30)22(19)29)9-8-26-10-12-32-13-11-26/h4-7,20,28H,8-13H2,1-3H3,(H,24,25)/b21-19+InChIKey
BOKBLLOZZOSPID-XUTLUUPISA-NSynonyms
1239711-99-9(4E)4((35dimethyl1Hpyrazol4yl)(hydroxy)methylidene)5(4methoxyphenyl)1(2(morpholin4yl)ethyl)pyrrolidine23dione
(4E)4((35dimethyl1Hpyrazol4yl)hydroxymethylidene)5(4methoxyphenyl)1(2morpholin4ylethyl)pyrrolidine23dione
1239711999
CC1=C(C(=NN1)C)C(=C2C(N(C(=O)C2=O)CCN3CCOCC3)C4=CC=C(C=C4)OC)O
COc1ccc(cc1)C1N(CCN2CCOCC2)C(=O)C(=O)C1=C(c1c(C)n(nH)c1C)O
InChI=1SC23H28N4O5c11418(15(2)252414)21(28)1920(164617(313)7516)27(23(30)22(19)29)9826101232131126h472028H813H213H3(H2425)b2119+
MFCD18162095
ZINC000102744513
ZINC000102744517
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