2-(2,3-dihydro-1H-inden-5-ylmethylamino)-7-(4-methoxybutyl)-3H-purin-6-one

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-ylmethylamino)-7-(4-methoxybutyl)-3H-purin-6-one Openeye Name: 2-(indan-5-ylmethylamino)-7-(4-methoxybutyl)-3H-purin-6-one CAS Name: 2-(2,3-dihydro-1H-inden-5-ylmethylamino)-7-(4-methoxybutyl)-3H-purin-6-one IUPAC Name: 2-(2,3-dihydro-1H-inden-5-ylmethylamino)-7-(4-methoxybutyl)-3H-purin-6-one Traditional Name: 2-(indan-5-ylmethylamino)-7-(4-methoxybutyl)-3H-purin-6-one Formula: C20H25N5O2 MolecularWeight: 367.4448

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Descriptors Computed from Structure

Canonical SMILES:

COCCCCN1C=NC2=C1C(=O)N=C(N2)NCC3=CC4=C(CCC4)C=C3

Isomeric SMILES

COCCCCN1C=NC2=C1C(=O)N=C(N2)NCC3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C20H25N5O2/c1-27-10-3-2-9-25-13-22-18-17(25)19(26)24-20(23-18)21-12-14-7-8-15-5-4-6-16(15)11-14/h7-8,11,13H,2-6,9-10,12H2,1H3,(H2,21,23,24,26)