Vitas-M small molecule compound
(E)-{2-[4-(benzyloxy)-3-ethoxyphenyl]-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
Catalog ID
STL052647
SMILES CCOc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C34H33N3O7 MW 595.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H33N3O7/c1-2-41-28-19-24(9-11-27(28)44-21-23-7-4-3-5-8-23)31-30(32(38)25-10-12-26-29(20-25)43-18-17-42-26)33(39)34(40)37(31)15-6-14-36-16-13-35-22-36/h3-5,7-13,16,19-20,22,31,38H,2,6,14-15,17-18,21H2,1H3/b32-30+InChIKey
SWFGMACTOAJZAS-NHQGMKOOSA-NSynonyms
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)5(3ETHOXY4PHENYLMETHOXYPHENYL)1(3IMIDAZOL1YLPROPYL)PYRROLIDINE23DIONE
(E)(2(4(benzyloxy)3ethoxyphenyl)1(3(1Himidazol3ium1yl)propyl)45dioxopyrrolidin3ylidene)(23dihydro14benzodioxin6yl)methanolate
CCOC1=C(C=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CCCN5C=CN=C5)OCC6=CC=CC=C6
CCOc1cc(ccc1OCc1ccccc1)C1C(=C(c2ccc3c(c2)OCCO3)(O))C(=O)C(=O)N1CCCn1cc(nH+)c1
InChI=1SC34H33N3O7c1241281924(91127(28)4421237435823)3130(32(38)2510122629(2025)4318174226)33(39)34(40)37(31)15614361613352236h35713161920223138H261415171821H21H3b3230+
MFCD18249480
ZINC000102890649
ZINC000102890651
Check stock
See real-time availability and sample size for STL052647 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.