N-[1-[3-(6-azanyl-2-butyl-purin-9-yl)propyl]piperidin-4-yl]benzamide

Systemtic Name: N-[1-[3-(6-azanyl-2-butyl-purin-9-yl)propyl]piperidin-4-yl]benzamide Openeye Name: N-[1-[3-(6-amino-2-butyl-purin-9-yl)propyl]-4-piperidyl]benzamide CAS Name: N-[1-[3-(6-amino-2-butyl-9-purinyl)propyl]-4-piperidinyl]benzamide IUPAC Name: N-[1-[3-(6-amino-2-butylpurin-9-yl)propyl]piperidin-4-yl]benzamide Traditional Name: N-[1-[3-(6-amino-2-butyl-purin-9-yl)propyl]-4-piperidyl]benzamide Formula: C24H33N7O MolecularWeight: 435.56512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C(=N1)N)N=CN2CCCN3CCC(CC3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=NC2=C(C(=N1)N)N=CN2CCCN3CCC(CC3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H33N7O/c1-2-3-10-20-28-22(25)21-23(29-20)31(17-26-21)14-7-13-30-15-11-19(12-16-30)27-24(32)18-8-5-4-6-9-18/h4-6,8-9,17,19H,2-3,7,10-16H2,1H3,(H,27,32)(H2,25,28,29)