2-(3,4-dimethylphenyl)-N-(3-imidazol-1-ylpropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-N-(3-imidazol-1-ylpropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-N-(3-imidazol-1-ylpropyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-[3-(1-imidazolyl)propyl]-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-N-(3-imidazol-1-ylpropyl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-N-(3-imidazol-1-ylpropyl)-1,3-diketo-isoindoline-5-carboxamide Formula: C23H22N4O3 MolecularWeight: 402.44578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCCN4C=CN=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCCN4C=CN=C4)C

InChI

InChI=1S/C23H22N4O3/c1-15-4-6-18(12-16(15)2)27-22(29)19-7-5-17(13-20(19)23(27)30)21(28)25-8-3-10-26-11-9-24-14-26/h4-7,9,11-14H,3,8,10H2,1-2H3,(H,25,28)