Vitas-M small molecule compound
methyl 4-(2,5-dioxo-3-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}pyrrolidin-1-yl)benzoate
Catalog ID
STK002208
SMILES COC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)N1CCN(CC1)C/C=C/c1ccccc1
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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 C25H27N3O4 MW 433.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O4/c1-32-25(31)20-9-11-21(12-10-20)28-23(29)18-22(24(28)30)27-16-14-26(15-17-27)13-5-8-19-6-3-2-4-7-19/h2-12,22H,13-18H2,1H3/b8-5+InChIKey
BWFKSXOESQXZOQ-VMPITWQZSA-NSynonyms
(E)methyl4(3(4cinnamylpiperazin1yl)25dioxopyrrolidin1yl)benzoate
COC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCN(CC3)CC=CC4=CC=CC=C4
COC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)N1CCN(CC1)CC=Cc1ccccc1
InChI=1SC25H27N3O4c13225(31)2091121(121020)2823(29)1822(24(28)30)27161426(151727)1358196324719h21222H1318H21H3b85+
METHYL4(25DIOXO3(4((2E)3PHENYLPROP2EN1YL)PIPERAZIN1YL)PYRROLIDIN1YL)BENZOATE
METHYL4(25DIOXO3(4((E)3PHENYLPROP2ENYL)PIPERAZIN1YL)PYRROLIDIN1YL)BENZOATE
MFCD01625410
STK002208
ZINC000022802347
ZINC000100279148
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