2-azanyl-9-[2-methylidene-3-(phenylmethoxymethyl)-4-(phenylmethyl)cyclopentyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[2-methylidene-3-(phenylmethoxymethyl)-4-(phenylmethyl)cyclopentyl]-3H-purin-6-one Openeye Name: 2-amino-9-[4-benzyl-3-(benzyloxymethyl)-2-methylene-cyclopentyl]-3H-purin-6-one CAS Name: 2-amino-9-[2-methylene-3-(phenylmethoxymethyl)-4-(phenylmethyl)cyclopentyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[4-benzyl-2-methylidene-3-(phenylmethoxymethyl)cyclopentyl]-3H-purin-6-one Traditional Name: 2-amino-9-[3-(benzoxymethyl)-4-benzyl-2-methylene-cyclopentyl]-3H-purin-6-one Formula: C26H27N5O2 MolecularWeight: 441.52488

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(CC(C1COCC2=CC=CC=C2)CC3=CC=CC=C3)N4C=NC5=C4NC(=NC5=O)N

Isomeric SMILES

C=C1C(CC(C1COCC2=CC=CC=C2)CC3=CC=CC=C3)N4C=NC5=C4NC(=NC5=O)N

InChI

InChI=1S/C26H27N5O2/c1-17-21(15-33-14-19-10-6-3-7-11-19)20(12-18-8-4-2-5-9-18)13-22(17)31-16-28-23-24(31)29-26(27)30-25(23)32/h2-11,16,20-22H,1,12-15H2,(H3,27,29,30,32)