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

Systemtic Name: 2-(3-methoxypropyl)-1,3-bis(oxidanylidene)-N-(2-pyrazol-1-ylpyridin-3-yl)isoindole-5-carboxamide Openeye Name: 2-(3-methoxypropyl)-1,3-dioxo-N-(2-pyrazol-1-yl-3-pyridyl)isoindoline-5-carboxamide CAS Name: 2-(3-methoxypropyl)-1,3-dioxo-N-[2-(1-pyrazolyl)-3-pyridinyl]-5-isoindolecarboxamide IUPAC Name: 2-(3-methoxypropyl)-1,3-dioxo-N-(2-pyrazol-1-ylpyridin-3-yl)isoindole-5-carboxamide Traditional Name: 1,3-diketo-2-(3-methoxypropyl)-N-(2-pyrazol-1-yl-3-pyridyl)isoindoline-5-carboxamide Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=C(N=CC=C3)N4C=CC=N4

Isomeric SMILES

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=C(N=CC=C3)N4C=CC=N4

InChI

InChI=1S/C21H19N5O4/c1-30-12-4-10-25-20(28)15-7-6-14(13-16(15)21(25)29)19(27)24-17-5-2-8-22-18(17)26-11-3-9-23-26/h2-3,5-9,11,13H,4,10,12H2,1H3,(H,24,27)