9-ethyl-N-(3-nitrophenyl)-2-(4-phenylpiperazin-1-yl)purin-6-amine

Systemtic Name: 9-ethyl-N-(3-nitrophenyl)-2-(4-phenylpiperazin-1-yl)purin-6-amine Openeye Name: 9-ethyl-N-(3-nitrophenyl)-2-(4-phenylpiperazin-1-yl)purin-6-amine CAS Name: 9-ethyl-N-(3-nitrophenyl)-2-(4-phenyl-1-piperazinyl)-6-purinamine IUPAC Name: 9-ethyl-N-(3-nitrophenyl)-2-(4-phenylpiperazin-1-yl)purin-6-amine Traditional Name: [9-ethyl-2-(4-phenylpiperazino)purin-6-yl]-(3-nitrophenyl)amine Formula: C23H24N8O2 MolecularWeight: 444.48906

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)[N+](=O)[O-])N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)[N+](=O)[O-])N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C23H24N8O2/c1-2-28-16-24-20-21(25-17-7-6-10-19(15-17)31(32)33)26-23(27-22(20)28)30-13-11-29(12-14-30)18-8-4-3-5-9-18/h3-10,15-16H,2,11-14H2,1H3,(H,25,26,27)