6-(3-oxidanylpropylamino)-3-phenyl-7-propyl-purin-2-one

Systemtic Name: 6-(3-oxidanylpropylamino)-3-phenyl-7-propyl-purin-2-one Openeye Name: 6-(3-hydroxypropylamino)-3-phenyl-7-propyl-purin-2-one CAS Name: 6-(3-hydroxypropylamino)-3-phenyl-7-propyl-2-purinone IUPAC Name: 6-(3-hydroxypropylamino)-3-phenyl-7-propylpurin-2-one Traditional Name: 6-(3-hydroxypropylamino)-3-phenyl-7-propyl-purin-2-one Formula: C17H21N5O2 MolecularWeight: 327.38094

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1C(=NC(=O)N2C3=CC=CC=C3)NCCCO

Isomeric SMILES

CCCN1C=NC2=C1C(=NC(=O)N2C3=CC=CC=C3)NCCCO

InChI

InChI=1S/C17H21N5O2/c1-2-10-21-12-19-16-14(21)15(18-9-6-11-23)20-17(24)22(16)13-7-4-3-5-8-13/h3-5,7-8,12,23H,2,6,9-11H2,1H3,(H,18,20,24)