2-(4-aminophenyl)-7-(3-phenylpropyl)-3H-purin-6-one

Systemtic Name: 2-(4-aminophenyl)-7-(3-phenylpropyl)-3H-purin-6-one Openeye Name: 2-(4-aminophenyl)-7-(3-phenylpropyl)-3H-purin-6-one CAS Name: 2-(4-aminophenyl)-7-(3-phenylpropyl)-3H-purin-6-one IUPAC Name: 2-(4-aminophenyl)-7-(3-phenylpropyl)-3H-purin-6-one Traditional Name: 2-(4-aminophenyl)-7-(3-phenylpropyl)-3H-purin-6-one Formula: C20H19N5O MolecularWeight: 345.39776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCN2C=NC3=C2C(=O)N=C(N3)C4=CC=C(C=C4)N

Isomeric SMILES

C1=CC=C(C=C1)CCCN2C=NC3=C2C(=O)N=C(N3)C4=CC=C(C=C4)N

InChI

InChI=1S/C20H19N5O/c21-16-10-8-15(9-11-16)18-23-19-17(20(26)24-18)25(13-22-19)12-4-7-14-5-2-1-3-6-14/h1-3,5-6,8-11,13H,4,7,12,21H2,(H,23,24,26)