8-(cyclopentylmethyl)-2-[[1-(hydroxymethyl)cyclopentyl]amino]-1-methyl-7-(phenylmethyl)purin-6-one

Systemtic Name: 8-(cyclopentylmethyl)-2-[[1-(hydroxymethyl)cyclopentyl]amino]-1-methyl-7-(phenylmethyl)purin-6-one Openeye Name: 7-benzyl-8-(cyclopentylmethyl)-2-[[1-(hydroxymethyl)cyclopentyl]amino]-1-methyl-purin-6-one CAS Name: 8-(cyclopentylmethyl)-2-[[1-(hydroxymethyl)cyclopentyl]amino]-1-methyl-7-(phenylmethyl)-6-purinone IUPAC Name: 7-benzyl-8-(cyclopentylmethyl)-2-[[1-(hydroxymethyl)cyclopentyl]amino]-1-methylpurin-6-one Traditional Name: 7-benzyl-8-(cyclopentylmethyl)-1-methyl-2-[(1-methylolcyclopentyl)amino]purin-6-one Formula: C25H33N5O2 MolecularWeight: 435.56182

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C(N2CC3=CC=CC=C3)CC4CCCC4)N=C1NC5(CCCC5)CO

Isomeric SMILES

CN1C(=O)C2=C(N=C(N2CC3=CC=CC=C3)CC4CCCC4)N=C1NC5(CCCC5)CO

InChI

InChI=1S/C25H33N5O2/c1-29-23(32)21-22(27-24(29)28-25(17-31)13-7-8-14-25)26-20(15-18-9-5-6-10-18)30(21)16-19-11-3-2-4-12-19/h2-4,11-12,18,31H,5-10,13-17H2,1H3,(H,27,28)