Vitas-M small molecule compound
2-({(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Catalog ID
STK280733
SMILES COc1cc(/C=N/N2C(=O)C3C(C2=O)C2CCC3C=C2)ccc1OCc1ccccc1
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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 C25H24N2O4 MW 416.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O4/c1-30-21-13-17(7-12-20(21)31-15-16-5-3-2-4-6-16)14-26-27-24(28)22-18-8-9-19(11-10-18)23(22)25(27)29/h2-9,12-14,18-19,22-23H,10-11,15H2,1H3/b26-14+InChIKey
SMXYZILQXMJANA-VULFUBBASA-NSynonyms
2(((E)(4(benzyloxy)3methoxyphenyl)methylidene)amino)3a477atetrahydro1H47ethanoisoindole13(2H)dione
COC1=C(C=CC(=C1)C=NN2C(=O)C3C4CCC(C3C2=O)C=C4)OCC5=CC=CC=C5
COc1cc(C=NN2C(=O)C3C(C2=O)C2CCC3C=C2)ccc1OCc1ccccc1
InChI=1SC25H24N2O4c130211317(71220(21)3115165324616)14262724(28)22188919(111018)23(22)25(27)29h29121418192223H101115H21H3b2614+
MFCD01053555
ZINC000100175866
ZINC000107876829
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