Vitas-M small molecule compound
(E)-2,3-dihydro-1,4-benzodioxin-6-yl{2-[4-(dimethylamino)phenyl]-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STK580070
SMILES C[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/[O-])/C1c1ccc(cc1)N(C)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 C25H29N3O5 MW 451.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O5/c1-26(2)11-12-28-22(16-5-8-18(9-6-16)27(3)4)21(24(30)25(28)31)23(29)17-7-10-19-20(15-17)33-14-13-32-19/h5-10,15,22,29H,11-14H2,1-4H3/b23-21+InChIKey
LCIABYSFVABTPA-XTQSDGFTSA-NSynonyms
620559-35-5(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1(2DIMETHYLAMINOETHYL)5(4DIMETHYLAMINOPHENYL)PYRROLIDINE23DIONE
(E)23dihydro14benzodioxin6yl(2(4(dimethylamino)phenyl)1(2(dimethylammonio)ethyl)45dioxopyrrolidin3ylidene)methanolate
(E)23dihydro14benzodioxin6yl(2(4(dimethylamino)phenyl)1(2(dimethylazaniumyl)ethyl)45dioxopyrrolidin3ylidene)methanolate
620559355
C(NH+)(C)CCN1C(C(=C(C2=CC3=C(C=C2)OCCO3)(O))C(=O)C1=O)C4=CC=C(C=C4)N(C)C
C(NH+)(CCN1C(=O)C(=O)C(=C(c2ccc3c(c2)OCCO3)(O))C1c1ccc(cc1)N(C)C)C
InChI=1SC25H29N3O5c126(2)11122822(165818(9616)27(3)4)21(24(30)25(28)31)23(29)177101920(1517)3314133219h510152229H1114H214H3b2321+
MFCD07207596
ZINC000102587894
ZINC000102587898
Check stock
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