N-[6-(benzimidazol-1-yl)pyridin-3-yl]-2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-[6-(benzimidazol-1-yl)pyridin-3-yl]-2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-[6-(benzimidazol-1-yl)-3-pyridyl]-2-(3-methoxypropyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[6-(1-benzimidazolyl)-3-pyridinyl]-2-(3-methoxypropyl)-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-[6-(benzimidazol-1-yl)pyridin-3-yl]-2-(3-methoxypropyl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-[6-(benzimidazol-1-yl)-3-pyridyl]-1,3-diketo-2-(3-methoxypropyl)isoindoline-5-carboxamide Formula: C25H21N5O4 MolecularWeight: 455.46534

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CN=C(C=C3)N4C=NC5=CC=CC=C54

Isomeric SMILES

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CN=C(C=C3)N4C=NC5=CC=CC=C54

InChI

InChI=1S/C25H21N5O4/c1-34-12-4-11-29-24(32)18-9-7-16(13-19(18)25(29)33)23(31)28-17-8-10-22(26-14-17)30-15-27-20-5-2-3-6-21(20)30/h2-3,5-10,13-15H,4,11-12H2,1H3,(H,28,31)