7-[(3-chlorophenyl)methyl]-2-propyl-3H-purin-6-one

Systemtic Name: 7-[(3-chlorophenyl)methyl]-2-propyl-3H-purin-6-one Openeye Name: 7-[(3-chlorophenyl)methyl]-2-propyl-3H-purin-6-one CAS Name: 7-[(3-chlorophenyl)methyl]-2-propyl-3H-purin-6-one IUPAC Name: 7-[(3-chlorophenyl)methyl]-2-propyl-3H-purin-6-one Traditional Name: 7-(3-chlorobenzyl)-2-propyl-3H-purin-6-one Formula: C15H15ClN4O MolecularWeight: 302.7588

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=O)C2=C(N1)N=CN2CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCCC1=NC(=O)C2=C(N1)N=CN2CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C15H15ClN4O/c1-2-4-12-18-14-13(15(21)19-12)20(9-17-14)8-10-5-3-6-11(16)7-10/h3,5-7,9H,2,4,8H2,1H3,(H,18,19,21)