1,3-bis(oxidanylidene)-2-(phenylmethyl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]isoindole-5-carboxamide

Systemtic Name: 1,3-bis(oxidanylidene)-2-(phenylmethyl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]isoindole-5-carboxamide Openeye Name: 2-benzyl-1,3-dioxo-N-[2-(4-phenylpiperazin-1-yl)ethyl]isoindoline-5-carboxamide CAS Name: 1,3-dioxo-2-(phenylmethyl)-N-[2-(4-phenyl-1-piperazinyl)ethyl]-5-isoindolecarboxamide IUPAC Name: 2-benzyl-1,3-dioxo-N-[2-(4-phenylpiperazin-1-yl)ethyl]isoindole-5-carboxamide Traditional Name: 2-benzyl-1,3-diketo-N-[2-(4-phenylpiperazino)ethyl]isoindoline-5-carboxamide Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCNC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H28N4O3/c33-26(29-13-14-30-15-17-31(18-16-30)23-9-5-2-6-10-23)22-11-12-24-25(19-22)28(35)32(27(24)34)20-21-7-3-1-4-8-21/h1-12,19H,13-18,20H2,(H,29,33)