Vitas-M small molecule compound

butyl 4-[3-(4-methylpiperazin-1-yl)-2,5-dioxopyrrolidin-1-yl]benzoate

Catalog ID
STL018865
SMILES CCCCOC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)N1CCN(CC1)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 C20H27N3O4 MW 373.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O4/c1-3-4-13-27-20(26)15-5-7-16(8-6-15)23-18(24)14-17(19(23)25)22-11-9-21(2)10-12-22/h5-8,17H,3-4,9-14H2,1-2H3
InChIKey
UVBAFAQVSYASCV-UHFFFAOYSA-N
Synonyms
361999-64-6
361999646
BUTYL4((3R)3(4METHYLPIPERAZIN1YL)25DIOXOPYRROLIDIN1YL)BENZOATE
butyl4(3(4methylpiperazin1yl)25dioxopyrrolidin1yl)benzoate
CCCCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCN(CC3)C
InChI=1SC20H27N3O4c134132720(26)155716(8615)2318(24)1417(19(23)25)2211921(2)101222h5817H34914H212H3
MFCD02153457
ZINC000019372599
ZINC000100821405

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.