7-methyl-3,8-bis(phenylmethyl)-1-propyl-purine-2,6-dione

Systemtic Name: 7-methyl-3,8-bis(phenylmethyl)-1-propyl-purine-2,6-dione Openeye Name: 3,8-dibenzyl-7-methyl-1-propyl-purine-2,6-dione CAS Name: 7-methyl-3,8-bis(phenylmethyl)-1-propylpurine-2,6-dione IUPAC Name: 3,8-dibenzyl-7-methyl-1-propylpurine-2,6-dione Traditional Name: 3,8-dibenzyl-7-methyl-1-propyl-xanthine Formula: C23H24N4O2 MolecularWeight: 388.46226

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C(N2C)CC3=CC=CC=C3)N(C1=O)CC4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)C2=C(N=C(N2C)CC3=CC=CC=C3)N(C1=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H24N4O2/c1-3-14-26-22(28)20-21(27(23(26)29)16-18-12-8-5-9-13-18)24-19(25(20)2)15-17-10-6-4-7-11-17/h4-13H,3,14-16H2,1-2H3