1,3-dimethyl-7-[3-(4-phenylpiperazin-1-yl)propyl]-8-propoxy-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-[3-(4-phenylpiperazin-1-yl)propyl]-8-propoxy-purine-2,6-dione Openeye Name: 1,3-dimethyl-7-[3-(4-phenylpiperazin-1-yl)propyl]-8-propoxy-purine-2,6-dione CAS Name: 1,3-dimethyl-7-[3-(4-phenyl-1-piperazinyl)propyl]-8-propoxypurine-2,6-dione IUPAC Name: 1,3-dimethyl-7-[3-(4-phenylpiperazin-1-yl)propyl]-8-propoxypurine-2,6-dione Traditional Name: 1,3-dimethyl-7-[3-(4-phenylpiperazino)propyl]-8-propoxy-xanthine Formula: C23H32N6O3 MolecularWeight: 440.53858

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NC2=C(N1CCCN3CCN(CC3)C4=CC=CC=C4)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCCOC1=NC2=C(N1CCCN3CCN(CC3)C4=CC=CC=C4)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C23H32N6O3/c1-4-17-32-22-24-20-19(21(30)26(3)23(31)25(20)2)29(22)12-8-11-27-13-15-28(16-14-27)18-9-6-5-7-10-18/h5-7,9-10H,4,8,11-17H2,1-3H3