2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]ethanamide

Systemtic Name: 2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]ethanamide Openeye Name: 2-(5-bromo-1,3-dioxo-isoindolin-2-yl)-N-[(6-pyrrolidin-1-yl-3-pyridyl)methyl]acetamide CAS Name: 2-(5-bromo-1,3-dioxo-2-isoindolyl)-N-[[6-(1-pyrrolidinyl)-3-pyridinyl]methyl]acetamide IUPAC Name: 2-(5-bromo-1,3-dioxoisoindol-2-yl)-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]acetamide Traditional Name: 2-(5-bromo-1,3-diketo-isoindolin-2-yl)-N-[(6-pyrrolidino-3-pyridyl)methyl]acetamide Formula: C20H19BrN4O3 MolecularWeight: 443.29386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=C(C=C2)CNC(=O)CN3C(=O)C4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1CCN(C1)C2=NC=C(C=C2)CNC(=O)CN3C(=O)C4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C20H19BrN4O3/c21-14-4-5-15-16(9-14)20(28)25(19(15)27)12-18(26)23-11-13-3-6-17(22-10-13)24-7-1-2-8-24/h3-6,9-10H,1-2,7-8,11-12H2,(H,23,26)