N-(3-azanylidene-1H-isoindol-2-yl)-3-(4-phenylpiperazin-1-yl)propanamide hydrobromide

Systemtic Name: N-(3-azanylidene-1H-isoindol-2-yl)-3-(4-phenylpiperazin-1-yl)propanamide hydrobromide Openeye Name: N-(1-iminoisoindolin-2-yl)-3-(4-phenylpiperazin-1-yl)propanamide hydrobromide CAS Name: N-(3-imino-1H-isoindol-2-yl)-3-(4-phenyl-1-piperazinyl)propanamide hydrobromide IUPAC Name: N-(3-imino-1H-isoindol-2-yl)-3-(4-phenylpiperazin-1-yl)propanamide hydrobromide Traditional Name: N-(1-iminoisoindolin-2-yl)-3-(4-phenylpiperazino)propionamide hydrobromide Formula: C21H26BrN5O MolecularWeight: 444.36804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NN2CC3=CC=CC=C3C2=N)C4=CC=CC=C4.Br

Isomeric SMILES

C1CN(CCN1CCC(=O)NN2CC3=CC=CC=C3C2=N)C4=CC=CC=C4.Br

InChI

InChI=1S/C21H25N5O.BrH/c22-21-19-9-5-4-6-17(19)16-26(21)23-20(27)10-11-24-12-14-25(15-13-24)18-7-2-1-3-8-18;/h1-9,22H,10-16H2,(H,23,27);1H