Vitas-M small molecule compound
methyl N-[6-(5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)hexanoyl]-beta-alaninate
Catalog ID
STL551172
SMILES COC(=O)CCNC(=O)CCCCCN1C(=O)c2ccccc2N2C1c1ccccc1C2=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 C25H27N3O5 MW 449.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O5/c1-33-22(30)14-15-26-21(29)13-3-2-8-16-27-23-17-9-4-5-10-18(17)25(32)28(23)20-12-7-6-11-19(20)24(27)31/h4-7,9-12,23H,2-3,8,13-16H2,1H3,(H,26,29)InChIKey
DDUDXACDHBZWRI-UHFFFAOYSA-NSynonyms
129895722
InChI=1SC25H27N3O5c13322(30)14152621(29)13328162723179451018(17)25(32)28(23)2012761119(20)24(27)31h4791223H2381316H21H3(H2629)
methyl3(6(511dioxo6~(a)~(H)isoindolo(21a)quinazolin6yl)hexanoylamino)propanoate
methyl3(6(511dioxoisoindolo(21a)quinazolin6(5H6aH11H)yl)hexanamido)propanoate
methylN(6(511dioxo6a11dihydroisoindolo(21a)quinazolin6(5H)yl)hexanoyl)betaalaninate
MFCD31757988
ZINC000524731596
ZINC000524731597
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