Vitas-M small molecule compound
(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-7-{[benzyl(methyl)amino]methyl}-6-hydroxy-1-benzofuran-3(2H)-one
Catalog ID
STL033364
SMILES CN(Cc1c(O)ccc2c1O/C(=C\c1ccc3c(c1)OCO3)/C2=O)Cc1ccccc1
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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 C25H21NO5 MW 415.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21NO5/c1-26(13-16-5-3-2-4-6-16)14-19-20(27)9-8-18-24(28)23(31-25(18)19)12-17-7-10-21-22(11-17)30-15-29-21/h2-12,27H,13-15H2,1H3/b23-12-InChIKey
LOEXTUMFTKFTCW-FMCGGJTJSA-NSynonyms
859661-05-5(2Z)2(13benzodioxol5ylmethylidene)7((benzyl(methyl)amino)methyl)6hydroxy1benzofuran3(2H)one
(2Z)2(13BENZODIOXOL5YLMETHYLIDENE)7((BENZYL(METHYL)AMINO)METHYL)6HYDROXY1BENZOFURAN3ONE
(Z)2(benzo(d)(13)dioxol5ylmethylene)7((benzyl(methyl)amino)methyl)6hydroxybenzofuran3(2H)one
2(2HBENZO(34D)13DIOXOLEN5YLMETHYLENE)6HYDROXY7((METHYLBENZYLAMINO)METHYL)BENZO(B)FURAN3ONE
CN(CC1=CC=CC=C1)CC2=C(C=CC3=C2OC(=CC4=CC5=C(C=C4)OCO5)C3=O)O
CN(Cc1c(O)ccc2c1OC(=Cc1ccc3c(c1)OCO3)C2=O)Cc1ccccc1
InChI=1SC25H21NO5c126(13165324616)141920(27)981824(28)23(3125(18)19)12177102122(1117)30152921h21227H1315H21H3b2312
ZINC20611162
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