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

Systemtic Name: 8-cyclopentyl-1-propyl-3-(3-pyridin-3-ylpropyl)-7H-purine-2,6-dione Openeye Name: 8-cyclopentyl-1-propyl-3-[3-(3-pyridyl)propyl]-7H-purine-2,6-dione CAS Name: 8-cyclopentyl-1-propyl-3-[3-(3-pyridinyl)propyl]-7H-purine-2,6-dione IUPAC Name: 8-cyclopentyl-1-propyl-3-(3-pyridin-3-ylpropyl)-7H-purine-2,6-dione Traditional Name: 8-cyclopentyl-1-propyl-3-[3-(3-pyridyl)propyl]-7H-purine-2,6-quinone Formula: C21H27N5O2 MolecularWeight: 381.47138

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C(N2)C3CCCC3)N(C1=O)CCCC4=CN=CC=C4

Isomeric SMILES

CCCN1C(=O)C2=C(N=C(N2)C3CCCC3)N(C1=O)CCCC4=CN=CC=C4

InChI

InChI=1S/C21H27N5O2/c1-2-12-26-20(27)17-19(24-18(23-17)16-9-3-4-10-16)25(21(26)28)13-6-8-15-7-5-11-22-14-15/h5,7,11,14,16H,2-4,6,8-10,12-13H2,1H3,(H,23,24)