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

Systemtic Name: 2-[[1-(hydroxymethyl)cyclopentyl]amino]-1-methyl-7,8-bis(phenylmethyl)purin-6-one Openeye Name: 7,8-dibenzyl-2-[[1-(hydroxymethyl)cyclopentyl]amino]-1-methyl-purin-6-one CAS Name: 2-[[1-(hydroxymethyl)cyclopentyl]amino]-1-methyl-7,8-bis(phenylmethyl)-6-purinone IUPAC Name: 7,8-dibenzyl-2-[[1-(hydroxymethyl)cyclopentyl]amino]-1-methylpurin-6-one Traditional Name: 7,8-dibenzyl-1-methyl-2-[(1-methylolcyclopentyl)amino]purin-6-one Formula: C26H29N5O2 MolecularWeight: 443.54076

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C(N2CC3=CC=CC=C3)CC4=CC=CC=C4)N=C1NC5(CCCC5)CO

Isomeric SMILES

CN1C(=O)C2=C(N=C(N2CC3=CC=CC=C3)CC4=CC=CC=C4)N=C1NC5(CCCC5)CO

InChI

InChI=1S/C26H29N5O2/c1-30-24(33)22-23(28-25(30)29-26(18-32)14-8-9-15-26)27-21(16-19-10-4-2-5-11-19)31(22)17-20-12-6-3-7-13-20/h2-7,10-13,32H,8-9,14-18H2,1H3,(H,28,29)