3-[4-[3-[(3-bromophenyl)methyl-(pyridin-3-ylmethyl)amino]propyl]piperazin-1-yl]propan-1-amine

Systemtic Name: 3-[4-[3-[(3-bromophenyl)methyl-(pyridin-3-ylmethyl)amino]propyl]piperazin-1-yl]propan-1-amine Openeye Name: 3-[4-[3-[(3-bromophenyl)methyl-(3-pyridylmethyl)amino]propyl]piperazin-1-yl]propan-1-amine CAS Name: 3-[4-[3-[(3-bromophenyl)methyl-(3-pyridinylmethyl)amino]propyl]-1-piperazinyl]-1-propanamine IUPAC Name: 3-[4-[3-[(3-bromophenyl)methyl-(pyridin-3-ylmethyl)amino]propyl]piperazin-1-yl]propan-1-amine Traditional Name: 3-[4-(3-aminopropyl)piperazino]propyl-(3-bromobenzyl)-(3-pyridylmethyl)amine Formula: C23H34BrN5 MolecularWeight: 460.45356

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN)CCCN(CC2=CC(=CC=C2)Br)CC3=CN=CC=C3

Isomeric SMILES

C1CN(CCN1CCCN)CCCN(CC2=CC(=CC=C2)Br)CC3=CN=CC=C3

InChI

InChI=1S/C23H34BrN5/c24-23-7-1-5-21(17-23)19-29(20-22-6-2-9-26-18-22)12-4-11-28-15-13-27(14-16-28)10-3-8-25/h1-2,5-7,9,17-18H,3-4,8,10-16,19-20,25H2