2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[3-(4-phenylpiperazin-1-yl)propyl]ethanamide

Systemtic Name: 2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[3-(4-phenylpiperazin-1-yl)propyl]ethanamide Openeye Name: 2-(5-bromo-1,3-dioxo-isoindolin-2-yl)-N-[3-(4-phenylpiperazin-1-yl)propyl]acetamide CAS Name: 2-(5-bromo-1,3-dioxo-2-isoindolyl)-N-[3-(4-phenyl-1-piperazinyl)propyl]acetamide IUPAC Name: 2-(5-bromo-1,3-dioxoisoindol-2-yl)-N-[3-(4-phenylpiperazin-1-yl)propyl]acetamide Traditional Name: 2-(5-bromo-1,3-diketo-isoindolin-2-yl)-N-[3-(4-phenylpiperazino)propyl]acetamide Formula: C23H25BrN4O3 MolecularWeight: 485.3736

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCCNC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C23H25BrN4O3/c24-17-7-8-19-20(15-17)23(31)28(22(19)30)16-21(29)25-9-4-10-26-11-13-27(14-12-26)18-5-2-1-3-6-18/h1-3,5-8,15H,4,9-14,16H2,(H,25,29)