N-[3-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]propyl]-3-methyl-4-(7H-purin-8-yl)benzamide

Systemtic Name: N-[3-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]propyl]-3-methyl-4-(7H-purin-8-yl)benzamide Openeye Name: N-[3-[4-(5-chloro-2-methoxy-phenyl)piperazin-1-yl]propyl]-3-methyl-4-(7H-purin-8-yl)benzamide CAS Name: N-[3-[4-(5-chloro-2-methoxyphenyl)-1-piperazinyl]propyl]-3-methyl-4-(7H-purin-8-yl)benzamide IUPAC Name: N-[3-[4-(5-chloro-2-methoxyphenyl)piperazin-1-yl]propyl]-3-methyl-4-(7H-purin-8-yl)benzamide Traditional Name: N-[3-[4-(5-chloro-2-methoxy-phenyl)piperazino]propyl]-3-methyl-4-(7H-purin-8-yl)benzamide Formula: C27H30ClN7O2 MolecularWeight: 520.0258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCCCN2CCN(CC2)C3=C(C=CC(=C3)Cl)OC)C4=NC5=NC=NC=C5N4

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCCCN2CCN(CC2)C3=C(C=CC(=C3)Cl)OC)C4=NC5=NC=NC=C5N4

InChI

InChI=1S/C27H30ClN7O2/c1-18-14-19(4-6-21(18)25-32-22-16-29-17-31-26(22)33-25)27(36)30-8-3-9-34-10-12-35(13-11-34)23-15-20(28)5-7-24(23)37-2/h4-7,14-17H,3,8-13H2,1-2H3,(H,30,36)(H,29,31,32,33)