N-[2-(4,6-dimethylpyrimidin-2-yl)-3H-isoindol-1-ylidene]-3-phenoxy-benzamide

Systemtic Name: N-[2-(4,6-dimethylpyrimidin-2-yl)-3H-isoindol-1-ylidene]-3-phenoxy-benzamide Openeye Name: N-[2-(4,6-dimethylpyrimidin-2-yl)isoindolin-1-ylidene]-3-phenoxy-benzamide CAS Name: N-[2-(4,6-dimethyl-2-pyrimidinyl)-3H-isoindol-1-ylidene]-3-phenoxybenzamide IUPAC Name: N-[2-(4,6-dimethylpyrimidin-2-yl)-3H-isoindol-1-ylidene]-3-phenoxybenzamide Traditional Name: N-[2-(4,6-dimethylpyrimidin-2-yl)isoindolin-1-ylidene]-3-phenoxy-benzamide Formula: C27H22N4O2 MolecularWeight: 434.48918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CC3=CC=CC=C3C2=NC(=O)C4=CC(=CC=C4)OC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CC3=CC=CC=C3C2=NC(=O)C4=CC(=CC=C4)OC5=CC=CC=C5)C

InChI

InChI=1S/C27H22N4O2/c1-18-15-19(2)29-27(28-18)31-17-21-9-6-7-14-24(21)25(31)30-26(32)20-10-8-13-23(16-20)33-22-11-4-3-5-12-22/h3-16H,17H2,1-2H3