Vitas-M small molecule compound
(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-[4-(dimethylamino)phenyl]-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Catalog ID
STL050476
SMILES COCCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccc(cc1)N(C)C
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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 C25H28N2O6 MW 452.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O6/c1-26(2)18-8-5-16(6-9-18)22-21(24(29)25(30)27(22)11-4-12-31-3)23(28)17-7-10-19-20(15-17)33-14-13-32-19/h5-10,15,22,28H,4,11-14H2,1-3H3/b23-21+InChIKey
NCGQEEQNNXGZDR-XTQSDGFTSA-NSynonyms
573943-28-9(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)5(4(dimethylamino)phenyl)1(3methoxypropyl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)5(4DIMETHYLAMINOPHENYL)1(3METHOXYPROPYL)PYRROLIDINE23DIONE
573943289
CN(C)C1=CC=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CCCOC
COCCCN1C(=O)C(=O)C(=C(c2ccc3c(c2)OCCO3)O)C1c1ccc(cc1)N(C)C
InChI=1SC25H28N2O6c126(2)188516(6918)2221(24(29)25(30)27(22)11412313)23(28)177101920(1517)3314133219h510152228H41114H213H3b2321+
MFCD05724736
ZINC000102887945
ZINC000102887947
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