2-azanyl-9-(4-ethylphenyl)-3H-purin-6-one

Systemtic Name: 2-azanyl-9-(4-ethylphenyl)-3H-purin-6-one Openeye Name: 2-amino-9-(4-ethylphenyl)-3H-purin-6-one CAS Name: 2-amino-9-(4-ethylphenyl)-3H-purin-6-one IUPAC Name: 2-amino-9-(4-ethylphenyl)-3H-purin-6-one Traditional Name: 2-amino-9-(4-ethylphenyl)-3H-purin-6-one Formula: C13H13N5O MolecularWeight: 255.27522

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

CCC1=CC=C(C=C1)N2C=NC3=C2NC(=NC3=O)N

InChI

InChI=1S/C13H13N5O/c1-2-8-3-5-9(6-4-8)18-7-15-10-11(18)16-13(14)17-12(10)19/h3-7H,2H2,1H3,(H3,14,16,17,19)