N-[4-(1H-benzimidazol-2-yl)phenyl]-2-tert-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-tert-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-tert-butyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-tert-butyl-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-tert-butyl-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-tert-butyl-1,3-diketo-isoindoline-5-carboxamide Formula: C26H22N4O3 MolecularWeight: 438.47788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5N4

Isomeric SMILES

CC(C)(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C26H22N4O3/c1-26(2,3)30-24(32)18-13-10-16(14-19(18)25(30)33)23(31)27-17-11-8-15(9-12-17)22-28-20-6-4-5-7-21(20)29-22/h4-14H,1-3H3,(H,27,31)(H,28,29)