N-[(3E)-3-[1-cyano-2-(cyclopentylamino)-2-oxidanylidene-ethylidene]isoindol-1-yl]-2-methyl-benzamide

Systemtic Name: N-[(3E)-3-[1-cyano-2-(cyclopentylamino)-2-oxidanylidene-ethylidene]isoindol-1-yl]-2-methyl-benzamide Openeye Name: N-[(3E)-3-[1-cyano-2-(cyclopentylamino)-2-oxo-ethylidene]isoindol-1-yl]-2-methyl-benzamide CAS Name: N-[(3E)-3-[1-cyano-2-(cyclopentylamino)-2-oxoethylidene]-1-isoindolyl]-2-methylbenzamide IUPAC Name: N-[(3E)-3-[1-cyano-2-(cyclopentylamino)-2-oxoethylidene]isoindol-1-yl]-2-methylbenzamide Traditional Name: N-[(3E)-3-[1-cyano-2-(cyclopentylamino)-2-keto-ethylidene]isoindol-1-yl]-2-methyl-benzamide Formula: C24H22N4O2 MolecularWeight: 398.45708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=NC(=C(C#N)C(=O)NC3CCCC3)C4=CC=CC=C42

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=N/C(=C(\C#N)/C(=O)NC3CCCC3)/C4=CC=CC=C42

InChI

InChI=1S/C24H22N4O2/c1-15-8-2-5-11-17(15)23(29)28-22-19-13-7-6-12-18(19)21(27-22)20(14-25)24(30)26-16-9-3-4-10-16/h2,5-8,11-13,16H,3-4,9-10H2,1H3,(H,26,30)(H,27,28,29)/b21-20+