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

Systemtic Name: 9-[3-(4-phenylpiperazin-1-yl)propyl]-2-propan-2-yl-purin-6-amine Openeye Name: 2-isopropyl-9-[3-(4-phenylpiperazin-1-yl)propyl]purin-6-amine CAS Name: 9-[3-(4-phenyl-1-piperazinyl)propyl]-2-propan-2-yl-6-purinamine IUPAC Name: 9-[3-(4-phenylpiperazin-1-yl)propyl]-2-propan-2-ylpurin-6-amine Traditional Name: [2-isopropyl-9-[3-(4-phenylpiperazino)propyl]purin-6-yl]amine Formula: C21H29N7 MolecularWeight: 379.50186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C(=N1)N)N=CN2CCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=NC2=C(C(=N1)N)N=CN2CCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H29N7/c1-16(2)20-24-19(22)18-21(25-20)28(15-23-18)10-6-9-26-11-13-27(14-12-26)17-7-4-3-5-8-17/h3-5,7-8,15-16H,6,9-14H2,1-2H3,(H2,22,24,25)