2-(phenylmethyl)-9-[3-(4-phenylpiperazin-1-yl)propyl]purin-6-amine

Systemtic Name: 2-(phenylmethyl)-9-[3-(4-phenylpiperazin-1-yl)propyl]purin-6-amine Openeye Name: 2-benzyl-9-[3-(4-phenylpiperazin-1-yl)propyl]purin-6-amine CAS Name: 2-(phenylmethyl)-9-[3-(4-phenyl-1-piperazinyl)propyl]-6-purinamine IUPAC Name: 2-benzyl-9-[3-(4-phenylpiperazin-1-yl)propyl]purin-6-amine Traditional Name: [2-benzyl-9-[3-(4-phenylpiperazino)propyl]purin-6-yl]amine Formula: C25H29N7 MolecularWeight: 427.54466

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN2C=NC3=C2N=C(N=C3N)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCN2C=NC3=C2N=C(N=C3N)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H29N7/c26-24-23-25(29-22(28-24)18-20-8-3-1-4-9-20)32(19-27-23)13-7-12-30-14-16-31(17-15-30)21-10-5-2-6-11-21/h1-6,8-11,19H,7,12-18H2,(H2,26,28,29)