3-bromanyl-N-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-4-(7H-purin-8-yl)benzamide

Systemtic Name: 3-bromanyl-N-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-4-(7H-purin-8-yl)benzamide Openeye Name: 3-bromo-N-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-4-(7H-purin-8-yl)benzamide CAS Name: 3-bromo-N-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-4-(7H-purin-8-yl)benzamide IUPAC Name: 3-bromo-N-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-4-(7H-purin-8-yl)benzamide Traditional Name: 3-bromo-N-[3-[4-(3-chlorophenyl)piperazino]propyl]-4-(7H-purin-8-yl)benzamide Formula: C25H25BrClN7O MolecularWeight: 554.8693

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)C2=CC(=C(C=C2)C3=NC4=NC=NC=C4N3)Br)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1CCCNC(=O)C2=CC(=C(C=C2)C3=NC4=NC=NC=C4N3)Br)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C25H25BrClN7O/c26-21-13-17(5-6-20(21)23-31-22-15-28-16-30-24(22)32-23)25(35)29-7-2-8-33-9-11-34(12-10-33)19-4-1-3-18(27)14-19/h1,3-6,13-16H,2,7-12H2,(H,29,35)(H,28,30,31,32)