1,3-bis(oxidanylidene)-2-(phenylmethyl)-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]isoindole-5-carboxamide

Systemtic Name: 1,3-bis(oxidanylidene)-2-(phenylmethyl)-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]isoindole-5-carboxamide Openeye Name: 2-benzyl-1,3-dioxo-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]isoindoline-5-carboxamide CAS Name: 1,3-dioxo-2-(phenylmethyl)-N-[[2-(1-pyrazolyl)-3-pyridinyl]methyl]-5-isoindolecarboxamide IUPAC Name: 2-benzyl-1,3-dioxo-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]isoindole-5-carboxamide Traditional Name: 2-benzyl-1,3-diketo-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]isoindoline-5-carboxamide Formula: C25H19N5O3 MolecularWeight: 437.45006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCC4=C(N=CC=C4)N5C=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCC4=C(N=CC=C4)N5C=CC=N5

InChI

InChI=1S/C25H19N5O3/c31-23(27-15-19-8-4-11-26-22(19)30-13-5-12-28-30)18-9-10-20-21(14-18)25(33)29(24(20)32)16-17-6-2-1-3-7-17/h1-14H,15-16H2,(H,27,31)