7-bromanyl-1,3-dimethyl-8-[3-(4-phenylpiperazin-1-yl)propyl]purino[7,8-a]pyrimidine-2,4-dione

Systemtic Name: 7-bromanyl-1,3-dimethyl-8-[3-(4-phenylpiperazin-1-yl)propyl]purino[7,8-a]pyrimidine-2,4-dione Openeye Name: 7-bromo-1,3-dimethyl-8-[3-(4-phenylpiperazin-1-yl)propyl]purino[7,8-a]pyrimidine-2,4-dione CAS Name: 7-bromo-1,3-dimethyl-8-[3-(4-phenyl-1-piperazinyl)propyl]purino[7,8-a]pyrimidine-2,4-dione IUPAC Name: 7-bromo-1,3-dimethyl-8-[3-(4-phenylpiperazin-1-yl)propyl]purino[7,8-a]pyrimidine-2,4-dione Traditional Name: 7-bromo-1,3-dimethyl-8-[3-(4-phenylpiperazino)propyl]purino[7,8-a]pyrimidine-2,4-quinone Formula: C23H26BrN7O2 MolecularWeight: 512.40224

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3C=C(C(=NC3=N2)CCCN4CCN(CC4)C5=CC=CC=C5)Br

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3C=C(C(=NC3=N2)CCCN4CCN(CC4)C5=CC=CC=C5)Br

InChI

InChI=1S/C23H26BrN7O2/c1-27-20-19(21(32)28(2)23(27)33)31-15-17(24)18(25-22(31)26-20)9-6-10-29-11-13-30(14-12-29)16-7-4-3-5-8-16/h3-5,7-8,15H,6,9-14H2,1-2H3