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8-(5-methylfuran-2-yl)-3,7-bis(phenylmethyl)purine-2,6-dione

8-(5-methylfuran-2-yl)-3,7-bis(phenylmethyl)purine-2,6-dione

Systemtic Name:8-(5-methylfuran-2-yl)-3,7-bis(phenylmethyl)purine-2,6-dione
Openeye Name:3,7-dibenzyl-8-(5-methyl-2-furyl)purine-2,6-dione
CAS Name:8-(5-methyl-2-furanyl)-3,7-bis(phenylmethyl)purine-2,6-dione
IUPAC Name:3,7-dibenzyl-8-(5-methylfuran-2-yl)purine-2,6-dione
Traditional Name:3,7-dibenzyl-8-(5-methyl-2-furyl)xanthine
Formula: C24H20N4O3
MolecularWeight: 412.4406
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC3=C(N2CC4=CC=CC=C4)C(=O)NC(=O)N3CC5=CC=CC=C5


Isomeric SMILES

CC1=CC=C(O1)C2=NC3=C(N2CC4=CC=CC=C4)C(=O)NC(=O)N3CC5=CC=CC=C5


InChI

InChI=1S/C24H20N4O3/c1-16-12-13-19(31-16)21-25-22-20(27(21)14-17-8-4-2-5-9-17)23(29)26-24(30)28(22)15-18-10-6-3-7-11-18/h2-13H,14-15H2,1H3,(H,26,29,30)


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