Vitas-M small molecule compound
methyl 4-[(3E)-1-[3-(dimethylamino)propyl]-3-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-4,5-dioxopyrrolidin-2-yl]benzoate
Catalog ID
STK611200
SMILES COC(=O)c1ccc(cc1)C1N(CCCN(C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/O
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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 C32H34N2O6 MW 542.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H34N2O6/c1-21-7-5-8-22(19-21)20-40-26-15-13-24(14-16-26)29(35)27-28(23-9-11-25(12-10-23)32(38)39-4)34(31(37)30(27)36)18-6-17-33(2)3/h5,7-16,19,28,35H,6,17-18,20H2,1-4H3/b29-27+InChIKey
TYDLEXFZTURMMJ-ORIPQNMZSA-NSynonyms
836640-77-8836640778
CC1=CC(=CC=C1)COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)CCCN(C)C)C4=CC=C(C=C4)C(=O)OC)O
COC(=O)c1ccc(cc1)C1N(CCCN(C)C)C(=O)C(=O)C1=C(c1ccc(cc1)OCc1cccc(c1)C)O
InChI=1SC32H34N2O6c12175822(1921)204026151324(141626)29(35)2728(2391125(121023)32(38)394)34(31(37)30(27)36)1861733(2)3h5716192835H6171820H214H3b2927+
methyl4((3E)1(3(dimethylamino)propyl)3(hydroxy(4((3methylbenzyl)oxy)phenyl)methylidene)45dioxopyrrolidin2yl)benzoate
METHYL4((3E)1(3(DIMETHYLAMINO)PROPYL)3(HYDROXY(4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)45DIOXOPYRROLIDIN2YL)BENZOATE
MFCD08737307
ZINC000102708036
ZINC000102708039
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.