N-(1H-benzimidazol-2-yl)-1,3-bis(oxidanylidene)-2-(pyridin-4-ylmethyl)isoindole-5-carboxamide

Systemtic Name: N-(1H-benzimidazol-2-yl)-1,3-bis(oxidanylidene)-2-(pyridin-4-ylmethyl)isoindole-5-carboxamide Openeye Name: N-(1H-benzimidazol-2-yl)-1,3-dioxo-2-(4-pyridylmethyl)isoindoline-5-carboxamide CAS Name: N-(1H-benzimidazol-2-yl)-1,3-dioxo-2-(pyridin-4-ylmethyl)-5-isoindolecarboxamide IUPAC Name: N-(1H-benzimidazol-2-yl)-1,3-dioxo-2-(pyridin-4-ylmethyl)isoindole-5-carboxamide Traditional Name: N-(1H-benzimidazol-2-yl)-1,3-diketo-2-(4-pyridylmethyl)isoindoline-5-carboxamide Formula: C22H15N5O3 MolecularWeight: 397.3862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CC=NC=C5

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CC=NC=C5

InChI

InChI=1S/C22H15N5O3/c28-19(26-22-24-17-3-1-2-4-18(17)25-22)14-5-6-15-16(11-14)21(30)27(20(15)29)12-13-7-9-23-10-8-13/h1-11H,12H2,(H2,24,25,26,28)