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

Systemtic Name: 4-chloranyl-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]-4-chloro-benzamide CAS Name: 4-chloro-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]-4-chlorobenzamide Traditional Name: N-[3-[2-(benzylamino)-1-cyano-2-keto-ethylidene]isoindol-1-yl]-4-chloro-benzamide Formula: C25H17ClN4O2 MolecularWeight: 440.88108

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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=C(C=C4)Cl)C#N

Isomeric SMILES

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

InChI

InChI=1S/C25H17ClN4O2/c26-18-12-10-17(11-13-18)24(31)30-23-20-9-5-4-8-19(20)22(29-23)21(14-27)25(32)28-15-16-6-2-1-3-7-16/h1-13H,15H2,(H,28,32)(H,29,30,31)