N-[9-[2-oxidanylidene-4-phenylmethoxy-3-(phenylmethoxymethyl)cyclopentyl]purin-6-yl]ethanamide

Systemtic Name: N-[9-[2-oxidanylidene-4-phenylmethoxy-3-(phenylmethoxymethyl)cyclopentyl]purin-6-yl]ethanamide Openeye Name: N-[9-[4-benzyloxy-3-(benzyloxymethyl)-2-oxo-cyclopentyl]purin-6-yl]acetamide CAS Name: N-[9-[2-oxo-4-phenylmethoxy-3-(phenylmethoxymethyl)cyclopentyl]-6-purinyl]acetamide IUPAC Name: N-[9-[2-oxo-4-phenylmethoxy-3-(phenylmethoxymethyl)cyclopentyl]purin-6-yl]acetamide Traditional Name: N-[9-[4-benzoxy-3-(benzoxymethyl)-2-keto-cyclopentyl]purin-6-yl]acetamide Formula: C27H27N5O4 MolecularWeight: 485.53438

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=NC2=C1N=CN2C3CC(C(C3=O)COCC4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC(=O)NC1=NC=NC2=C1N=CN2C3CC(C(C3=O)COCC4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C27H27N5O4/c1-18(33)31-26-24-27(29-16-28-26)32(17-30-24)22-12-23(36-14-20-10-6-3-7-11-20)21(25(22)34)15-35-13-19-8-4-2-5-9-19/h2-11,16-17,21-23H,12-15H2,1H3,(H,28,29,31,33)