1-methyl-2-[[(1R,2R)-2-oxidanylcyclopentyl]amino]-8-[(4-phenylphenyl)methyl]-7H-purin-6-one

Systemtic Name: 1-methyl-2-[[(1R,2R)-2-oxidanylcyclopentyl]amino]-8-[(4-phenylphenyl)methyl]-7H-purin-6-one Openeye Name: 2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-1-methyl-8-[(4-phenylphenyl)methyl]-7H-purin-6-one CAS Name: 2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-1-methyl-8-[(4-phenylphenyl)methyl]-7H-purin-6-one IUPAC Name: 2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-1-methyl-8-[(4-phenylphenyl)methyl]-7H-purin-6-one Traditional Name: 2-[[(1R,2R)-2-hydroxycyclopentyl]amino]-1-methyl-8-(4-phenylbenzyl)-7H-purin-6-one Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C(N2)CC3=CC=C(C=C3)C4=CC=CC=C4)N=C1NC5CCCC5O

Isomeric SMILES

CN1C(=O)C2=C(N=C(N2)CC3=CC=C(C=C3)C4=CC=CC=C4)N=C1N[C@@H]5CCC[C@H]5O

InChI

InChI=1S/C24H25N5O2/c1-29-23(31)21-22(28-24(29)25-18-8-5-9-19(18)30)27-20(26-21)14-15-10-12-17(13-11-15)16-6-3-2-4-7-16/h2-4,6-7,10-13,18-19,30H,5,8-9,14H2,1H3,(H,25,28)(H,26,27)/t18-,19-/m1/s1