Vitas-M small molecule compound
2-({[1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)-2,3-dihydro-1H-isoindol-5-yl]carbonyl}amino)-4,5-dimethoxybenzoic acid
Catalog ID
STK061099
SMILES COc1cc(NC(=O)c2ccc3c(c2)C(=O)N(C3=O)CC2CCCO2)c(cc1OC)C(=O)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 C23H22N2O8 MW 454.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O8/c1-31-18-9-16(23(29)30)17(10-19(18)32-2)24-20(26)12-5-6-14-15(8-12)22(28)25(21(14)27)11-13-4-3-7-33-13/h5-6,8-10,13H,3-4,7,11H2,1-2H3,(H,24,26)(H,29,30)InChIKey
BPZOEGYBUGVRCE-UHFFFAOYSA-NSynonyms
405894-72-62(((13DIOXO2(TETRAHYDROFURAN2YLMETHYL)23DIHYDRO1HISOINDOL5YL)CARBONYL)AMINO)45DIMETHOXYBENZOICACID
2((13DIOXO2(OXOLAN2YLMETHYL)ISOINDOLE5CARBONYL)AMINO)45DIMETHOXYBENZOICACID
2(13dioxo2((tetrahydrofuran2yl)methyl)isoindoline5carboxamido)45dimethoxybenzoicacid
405894726
COC1=C(C=C(C(=C1)C(=O)O)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4CCCO4)OC
COc1cc(NC(=O)c2ccc3c(c2)C(=O)N(C3=O)CC2CCCO2)c(cc1OC)C(=O)O
InChI=1SC23H22N2O8c13118916(23(29)30)17(1019(18)322)2420(26)12561415(812)22(28)25(21(14)27)11134373313h5681013H34711H212H3(H2426)(H2930)
MFCD02032312
STK061099
ZINC000001216932
ZINC000001216933
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