N-[3-[1-cyano-2-oxidanylidene-2-[(phenylmethyl)amino]ethylidene]isoindol-1-yl]benzamide

Systemtic Name: N-[3-[1-cyano-2-oxidanylidene-2-[(phenylmethyl)amino]ethylidene]isoindol-1-yl]benzamide Openeye Name: N-[3-[2-(benzylamino)-1-cyano-2-oxo-ethylidene]isoindol-1-yl]benzamide CAS Name: N-[3-[1-cyano-2-oxo-2-[(phenylmethyl)amino]ethylidene]-1-isoindolyl]benzamide IUPAC Name: N-[3-[2-(benzylamino)-1-cyano-2-oxoethylidene]isoindol-1-yl]benzamide Traditional Name: N-[3-[2-(benzylamino)-1-cyano-2-keto-ethylidene]isoindol-1-yl]benzamide Formula: C25H18N4O2 MolecularWeight: 406.43602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(=C2C3=CC=CC=C3C(=N2)NC(=O)C4=CC=CC=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C(=C2C3=CC=CC=C3C(=N2)NC(=O)C4=CC=CC=C4)C#N

InChI

InChI=1S/C25H18N4O2/c26-15-21(25(31)27-16-17-9-3-1-4-10-17)22-19-13-7-8-14-20(19)23(28-22)29-24(30)18-11-5-2-6-12-18/h1-14H,16H2,(H,27,31)(H,28,29,30)