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1-cyclopentyl-3-(3-methoxyphenyl)-7-propyl-purine-2,6-dione

1-cyclopentyl-3-(3-methoxyphenyl)-7-propyl-purine-2,6-dione

Systemtic Name:1-cyclopentyl-3-(3-methoxyphenyl)-7-propyl-purine-2,6-dione
Openeye Name:1-cyclopentyl-3-(3-methoxyphenyl)-7-propyl-purine-2,6-dione
CAS Name:1-cyclopentyl-3-(3-methoxyphenyl)-7-propylpurine-2,6-dione
IUPAC Name:1-cyclopentyl-3-(3-methoxyphenyl)-7-propylpurine-2,6-dione
Traditional Name:1-cyclopentyl-3-(3-methoxyphenyl)-7-propyl-xanthine
Formula: C20H24N4O3
MolecularWeight: 368.42956
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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1C(=O)N(C(=O)N2C3=CC(=CC=C3)OC)C4CCCC4


Isomeric SMILES

CCCN1C=NC2=C1C(=O)N(C(=O)N2C3=CC(=CC=C3)OC)C4CCCC4


InChI

InChI=1S/C20H24N4O3/c1-3-11-22-13-21-18-17(22)19(25)24(14-7-4-5-8-14)20(26)23(18)15-9-6-10-16(12-15)27-2/h6,9-10,12-14H,3-5,7-8,11H2,1-2H3


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