2-butyl-N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-butyl-N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-butyl-N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-butyl-N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-butyl-N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-butyl-N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-1,3-diketo-isoindoline-5-carboxamide Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC=CC(=C3)C4=NN=CN4CC

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC=CC(=C3)C4=NN=CN4CC

InChI

InChI=1S/C23H23N5O3/c1-3-5-11-28-22(30)18-10-9-16(13-19(18)23(28)31)21(29)25-17-8-6-7-15(12-17)20-26-24-14-27(20)4-2/h6-10,12-14H,3-5,11H2,1-2H3,(H,25,29)