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

Systemtic Name: N-[3-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]propyl]-3-ethoxy-4-(7H-purin-8-yl)benzamide Openeye Name: N-[3-[4-(5-chloro-2-methoxy-phenyl)piperazin-1-yl]propyl]-3-ethoxy-4-(7H-purin-8-yl)benzamide CAS Name: N-[3-[4-(5-chloro-2-methoxyphenyl)-1-piperazinyl]propyl]-3-ethoxy-4-(7H-purin-8-yl)benzamide IUPAC Name: N-[3-[4-(5-chloro-2-methoxyphenyl)piperazin-1-yl]propyl]-3-ethoxy-4-(7H-purin-8-yl)benzamide Traditional Name: N-[3-[4-(5-chloro-2-methoxy-phenyl)piperazino]propyl]-3-ethoxy-4-(7H-purin-8-yl)benzamide Formula: C28H32ClN7O3 MolecularWeight: 550.05178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)NCCCN2CCN(CC2)C3=C(C=CC(=C3)Cl)OC)C4=NC5=NC=NC=C5N4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)NCCCN2CCN(CC2)C3=C(C=CC(=C3)Cl)OC)C4=NC5=NC=NC=C5N4

InChI

InChI=1S/C28H32ClN7O3/c1-3-39-25-15-19(5-7-21(25)26-33-22-17-30-18-32-27(22)34-26)28(37)31-9-4-10-35-11-13-36(14-12-35)23-16-20(29)6-8-24(23)38-2/h5-8,15-18H,3-4,9-14H2,1-2H3,(H,31,37)(H,30,32,33,34)