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

Systemtic Name: 2-(4-bromophenyl)-N-(3-imidazol-1-ylpropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-(4-bromophenyl)-N-(3-imidazol-1-ylpropyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-(4-bromophenyl)-N-[3-(1-imidazolyl)propyl]-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-(4-bromophenyl)-N-(3-imidazol-1-ylpropyl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-(4-bromophenyl)-N-(3-imidazol-1-ylpropyl)-1,3-diketo-isoindoline-5-carboxamide Formula: C21H17BrN4O3 MolecularWeight: 453.28868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCCN4C=CN=C4)Br

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCCN4C=CN=C4)Br

InChI

InChI=1S/C21H17BrN4O3/c22-15-3-5-16(6-4-15)26-20(28)17-7-2-14(12-18(17)21(26)29)19(27)24-8-1-10-25-11-9-23-13-25/h2-7,9,11-13H,1,8,10H2,(H,24,27)