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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCN4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCN4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C28H28N4O3/c1-20-7-5-6-10-25(20)32-27(34)23-12-11-21(19-24(23)28(32)35)26(33)29-13-14-30-15-17-31(18-16-30)22-8-3-2-4-9-22/h2-12,19H,13-18H2,1H3,(H,29,33)