N-phenethyl-9-(phenylmethyl)-2-piperazin-1-yl-purin-6-amine

Systemtic Name: N-phenethyl-9-(phenylmethyl)-2-piperazin-1-yl-purin-6-amine Openeye Name: 9-benzyl-N-phenethyl-2-piperazin-1-yl-purin-6-amine CAS Name: N-phenethyl-9-(phenylmethyl)-2-(1-piperazinyl)-6-purinamine IUPAC Name: 9-benzyl-N-phenethyl-2-piperazin-1-ylpurin-6-amine Traditional Name: (9-benzyl-2-piperazino-purin-6-yl)-phenethyl-amine Formula: C24H27N7 MolecularWeight: 413.51808

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC3=C(C(=N2)NCCC4=CC=CC=C4)N=CN3CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1)C2=NC3=C(C(=N2)NCCC4=CC=CC=C4)N=CN3CC5=CC=CC=C5

InChI

InChI=1S/C24H27N7/c1-3-7-19(8-4-1)11-12-26-22-21-23(29-24(28-22)30-15-13-25-14-16-30)31(18-27-21)17-20-9-5-2-6-10-20/h1-10,18,25H,11-17H2,(H,26,28,29)