N-[(3Z)-3-[1-cyano-2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethylidene]isoindol-1-yl]-4-methyl-benzamide

Systemtic Name: N-[(3Z)-3-[1-cyano-2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethylidene]isoindol-1-yl]-4-methyl-benzamide Openeye Name: N-[(3Z)-3-[1-cyano-2-oxo-2-(p-tolylmethylamino)ethylidene]isoindol-1-yl]-4-methyl-benzamide CAS Name: N-[(3Z)-3-[1-cyano-2-[(4-methylphenyl)methylamino]-2-oxoethylidene]-1-isoindolyl]-4-methylbenzamide IUPAC Name: N-[(3Z)-3-[1-cyano-2-[(4-methylphenyl)methylamino]-2-oxoethylidene]isoindol-1-yl]-4-methylbenzamide Traditional Name: N-[(3Z)-3-[1-cyano-2-keto-2-[(4-methylbenzyl)amino]ethylidene]isoindol-1-yl]-4-methyl-benzamide Formula: C27H22N4O2 MolecularWeight: 434.48918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C(=C2C3=CC=CC=C3C(=N2)NC(=O)C4=CC=C(C=C4)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)/C(=C\2/C3=CC=CC=C3C(=N2)NC(=O)C4=CC=C(C=C4)C)/C#N

InChI

InChI=1S/C27H22N4O2/c1-17-7-11-19(12-8-17)16-29-27(33)23(15-28)24-21-5-3-4-6-22(21)25(30-24)31-26(32)20-13-9-18(2)10-14-20/h3-14H,16H2,1-2H3,(H,29,33)(H,30,31,32)/b24-23-