2-azanyl-9-[4-phenylmethoxy-3-(phenylmethoxymethyl)butyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[4-phenylmethoxy-3-(phenylmethoxymethyl)butyl]-3H-purin-6-one Openeye Name: 2-amino-9-[4-benzyloxy-3-(benzyloxymethyl)butyl]-3H-purin-6-one CAS Name: 2-amino-9-[4-phenylmethoxy-3-(phenylmethoxymethyl)butyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[4-phenylmethoxy-3-(phenylmethoxymethyl)butyl]-3H-purin-6-one Traditional Name: 2-amino-9-[4-benzoxy-3-(benzoxymethyl)butyl]-3H-purin-6-one Formula: C24H27N5O3 MolecularWeight: 433.50288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(CCN2C=NC3=C2NC(=NC3=O)N)COCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COCC(CCN2C=NC3=C2NC(=NC3=O)N)COCC4=CC=CC=C4

InChI

InChI=1S/C24H27N5O3/c25-24-27-22-21(23(30)28-24)26-17-29(22)12-11-20(15-31-13-18-7-3-1-4-8-18)16-32-14-19-9-5-2-6-10-19/h1-10,17,20H,11-16H2,(H3,25,27,28,30)