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

Systemtic Name: 2-[[1-(hydroxymethyl)cyclopentyl]amino]-1-methyl-8-phenyl-7-(phenylmethyl)purin-6-one Openeye Name: 7-benzyl-2-[[1-(hydroxymethyl)cyclopentyl]amino]-1-methyl-8-phenyl-purin-6-one CAS Name: 2-[[1-(hydroxymethyl)cyclopentyl]amino]-1-methyl-8-phenyl-7-(phenylmethyl)-6-purinone IUPAC Name: 7-benzyl-2-[[1-(hydroxymethyl)cyclopentyl]amino]-1-methyl-8-phenylpurin-6-one Traditional Name: 7-benzyl-1-methyl-2-[(1-methylolcyclopentyl)amino]-8-phenyl-purin-6-one Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N5O2/c1-29-23(32)20-21(27-24(29)28-25(17-31)14-8-9-15-25)26-22(19-12-6-3-7-13-19)30(20)16-18-10-4-2-5-11-18/h2-7,10-13,31H,8-9,14-17H2,1H3,(H,27,28)