Vitas-M small molecule compound

methyl 4-{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl}benzoate

Catalog ID
STK080392
SMILES COC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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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 C24H25N3O6 MW 451.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O6/c1-31-24(30)17-3-5-18(6-4-17)27-22(28)13-19(23(27)29)26-10-8-25(9-11-26)14-16-2-7-20-21(12-16)33-15-32-20/h2-7,12,19H,8-11,13-15H2,1H3
InChIKey
LODABDKGICFFOU-UHFFFAOYSA-N
Synonyms
330865-50-4
330865504
COC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5
COC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2
InChI=1SC24H25N3O6c13124(30)173518(6417)2722(28)1319(23(27)29)2610825(91126)1416272021(1216)33153220h271219H8111315H21H3
METHYL4(3(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)25DIOXOPYRROLIDIN1YL)BENZOATE
methyl4(3(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)25dioxopyrrolidin1yl)benzoate
MFCD01471490
STK080392
ZINC000022784841
ZINC000095482815

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Available files

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