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

Systemtic Name: 1,3-dimethyl-7-[4-(4-phenylpiperazin-1-yl)butyl]-8-propoxy-purine-2,6-dione Openeye Name: 1,3-dimethyl-7-[4-(4-phenylpiperazin-1-yl)butyl]-8-propoxy-purine-2,6-dione CAS Name: 1,3-dimethyl-7-[4-(4-phenyl-1-piperazinyl)butyl]-8-propoxypurine-2,6-dione IUPAC Name: 1,3-dimethyl-7-[4-(4-phenylpiperazin-1-yl)butyl]-8-propoxypurine-2,6-dione Traditional Name: 1,3-dimethyl-7-[4-(4-phenylpiperazino)butyl]-8-propoxy-xanthine Formula: C24H34N6O3 MolecularWeight: 454.56516

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NC2=C(N1CCCCN3CCN(CC3)C4=CC=CC=C4)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCCOC1=NC2=C(N1CCCCN3CCN(CC3)C4=CC=CC=C4)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C24H34N6O3/c1-4-18-33-23-25-21-20(22(31)27(3)24(32)26(21)2)30(23)13-9-8-12-28-14-16-29(17-15-28)19-10-6-5-7-11-19/h5-7,10-11H,4,8-9,12-18H2,1-3H3