2-(2-methylphenyl)-1,3-bis(oxidanylidene)-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]isoindole-5-carboxamide

Systemtic Name: 2-(2-methylphenyl)-1,3-bis(oxidanylidene)-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]isoindole-5-carboxamide Openeye Name: 2-(o-tolyl)-1,3-dioxo-N-[(6-pyrazol-1-yl-3-pyridyl)methyl]isoindoline-5-carboxamide CAS Name: 2-(2-methylphenyl)-1,3-dioxo-N-[[6-(1-pyrazolyl)-3-pyridinyl]methyl]-5-isoindolecarboxamide IUPAC Name: 2-(2-methylphenyl)-1,3-dioxo-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]isoindole-5-carboxamide Traditional Name: 1,3-diketo-2-(o-tolyl)-N-[(6-pyrazol-1-yl-3-pyridyl)methyl]isoindoline-5-carboxamide Formula: C25H19N5O3 MolecularWeight: 437.45006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCC4=CN=C(C=C4)N5C=CC=N5

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCC4=CN=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C25H19N5O3/c1-16-5-2-3-6-21(16)30-24(32)19-9-8-18(13-20(19)25(30)33)23(31)27-15-17-7-10-22(26-14-17)29-12-4-11-28-29/h2-14H,15H2,1H3,(H,27,31)