8-cyclopentyl-1-propyl-3-(2-pyridin-4-ylethyl)-7H-purine-2,6-dione

Systemtic Name: 8-cyclopentyl-1-propyl-3-(2-pyridin-4-ylethyl)-7H-purine-2,6-dione Openeye Name: 8-cyclopentyl-1-propyl-3-[2-(4-pyridyl)ethyl]-7H-purine-2,6-dione CAS Name: 8-cyclopentyl-1-propyl-3-(2-pyridin-4-ylethyl)-7H-purine-2,6-dione IUPAC Name: 8-cyclopentyl-1-propyl-3-(2-pyridin-4-ylethyl)-7H-purine-2,6-dione Traditional Name: 8-cyclopentyl-1-propyl-3-[2-(4-pyridyl)ethyl]-7H-purine-2,6-quinone Formula: C20H25N5O2 MolecularWeight: 367.4448

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C(N2)C3CCCC3)N(C1=O)CCC4=CC=NC=C4

Isomeric SMILES

CCCN1C(=O)C2=C(N=C(N2)C3CCCC3)N(C1=O)CCC4=CC=NC=C4

InChI

InChI=1S/C20H25N5O2/c1-2-12-25-19(26)16-18(23-17(22-16)15-5-3-4-6-15)24(20(25)27)13-9-14-7-10-21-11-8-14/h7-8,10-11,15H,2-6,9,12-13H2,1H3,(H,22,23)