2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)-N-(6-pyrazol-1-ylpyridin-3-yl)isoindole-5-carboxamide

Systemtic Name: 2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)-N-(6-pyrazol-1-ylpyridin-3-yl)isoindole-5-carboxamide Openeye Name: 2-(4-ethoxyphenyl)-1,3-dioxo-N-(6-pyrazol-1-yl-3-pyridyl)isoindoline-5-carboxamide CAS Name: 2-(4-ethoxyphenyl)-1,3-dioxo-N-[6-(1-pyrazolyl)-3-pyridinyl]-5-isoindolecarboxamide IUPAC Name: 2-(4-ethoxyphenyl)-1,3-dioxo-N-(6-pyrazol-1-ylpyridin-3-yl)isoindole-5-carboxamide Traditional Name: 1,3-diketo-2-p-phenetyl-N-(6-pyrazol-1-yl-3-pyridyl)isoindoline-5-carboxamide Formula: C25H19N5O4 MolecularWeight: 453.44946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CN=C(C=C4)N5C=CC=N5

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CN=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C25H19N5O4/c1-2-34-19-8-6-18(7-9-19)30-24(32)20-10-4-16(14-21(20)25(30)33)23(31)28-17-5-11-22(26-15-17)29-13-3-12-27-29/h3-15H,2H2,1H3,(H,28,31)