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

Systemtic Name: 8-cyclopentyl-3-(phenylmethyl)-1-propyl-7H-purine-2,6-dione Openeye Name: 3-benzyl-8-cyclopentyl-1-propyl-7H-purine-2,6-dione CAS Name: 8-cyclopentyl-3-(phenylmethyl)-1-propyl-7H-purine-2,6-dione IUPAC Name: 3-benzyl-8-cyclopentyl-1-propyl-7H-purine-2,6-dione Traditional Name: 3-benzyl-8-cyclopentyl-1-propyl-7H-purine-2,6-quinone Formula: C20H24N4O2 MolecularWeight: 352.43016

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C(N2)C3CCCC3)N(C1=O)CC4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)C2=C(N=C(N2)C3CCCC3)N(C1=O)CC4=CC=CC=C4

InChI

InChI=1S/C20H24N4O2/c1-2-12-23-19(25)16-18(22-17(21-16)15-10-6-7-11-15)24(20(23)26)13-14-8-4-3-5-9-14/h3-5,8-9,15H,2,6-7,10-13H2,1H3,(H,21,22)