2-butyl-N-[[2-(dimethylamino)pyridin-3-yl]methyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-butyl-N-[[2-(dimethylamino)pyridin-3-yl]methyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-butyl-N-[[2-(dimethylamino)-3-pyridyl]methyl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-butyl-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-butyl-N-[[2-(dimethylamino)pyridin-3-yl]methyl]-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-butyl-N-[[2-(dimethylamino)-3-pyridyl]methyl]-1,3-diketo-isoindoline-5-carboxamide Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCC3=C(N=CC=C3)N(C)C

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCC3=C(N=CC=C3)N(C)C

InChI

InChI=1S/C21H24N4O3/c1-4-5-11-25-20(27)16-9-8-14(12-17(16)21(25)28)19(26)23-13-15-7-6-10-22-18(15)24(2)3/h6-10,12H,4-5,11,13H2,1-3H3,(H,23,26)