2-azanyl-1-(3-ethyl-4-methyl-phenyl)-7H-purin-6-one

Systemtic Name: 2-azanyl-1-(3-ethyl-4-methyl-phenyl)-7H-purin-6-one Openeye Name: 2-amino-1-(3-ethyl-4-methyl-phenyl)-7H-purin-6-one CAS Name: 2-amino-1-(3-ethyl-4-methylphenyl)-7H-purin-6-one IUPAC Name: 2-amino-1-(3-ethyl-4-methylphenyl)-7H-purin-6-one Traditional Name: 2-amino-1-(3-ethyl-4-methyl-phenyl)-7H-purin-6-one Formula: C14H15N5O MolecularWeight: 269.3018

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)N2C(=O)C3=C(N=CN3)N=C2N)C

Isomeric SMILES

CCC1=C(C=CC(=C1)N2C(=O)C3=C(N=CN3)N=C2N)C

InChI

InChI=1S/C14H15N5O/c1-3-9-6-10(5-4-8(9)2)19-13(20)11-12(17-7-16-11)18-14(19)15/h4-7H,3H2,1-2H3,(H2,15,18)(H,16,17)