Vitas-M small molecule compound
2-[(4-{(E)-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-ethanoisoindol-2-yl)imino]methyl}phenoxy)methyl]benzonitrile
Catalog ID
STK281886
SMILES N#Cc1ccccc1COc1ccc(cc1)/C=N/N1C(=O)C2C(C1=O)C1CCC2C=C1
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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 C25H21N3O3 MW 411.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O3/c26-13-19-3-1-2-4-20(19)15-31-21-11-5-16(6-12-21)14-27-28-24(29)22-17-7-8-18(10-9-17)23(22)25(28)30/h1-8,11-12,14,17-18,22-23H,9-10,15H2/b27-14+InChIKey
FGGLMAHLPJRVDT-MZJWZYIUSA-NSynonyms
2((4((E)((13dioxo133a477ahexahydro2H47ethanoisoindol2yl)imino)methyl)phenoxy)methyl)benzonitrile
C1CC2C=CC1C3C2C(=O)N(C3=O)N=CC4=CC=C(C=C4)OCC5=CC=CC=C5C#N
InChI=1SC25H21N3O3c261319312420(19)15312111516(61221)14272824(29)22177818(10917)23(22)25(28)30h1811121417182223H91015H2b2714+
MFCD03103065
N#Cc1ccccc1COc1ccc(cc1)C=NN1C(=O)C2C(C1=O)C1CCC2C=C1
ZINC000100237035
ZINC000107876931
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