2-(methylaminomethyl)-7-[(4-methylphenyl)methyl]-3H-purin-6-one

Systemtic Name: 2-(methylaminomethyl)-7-[(4-methylphenyl)methyl]-3H-purin-6-one Openeye Name: 2-(methylaminomethyl)-7-(p-tolylmethyl)-3H-purin-6-one CAS Name: 2-(methylaminomethyl)-7-[(4-methylphenyl)methyl]-3H-purin-6-one IUPAC Name: 2-(methylaminomethyl)-7-[(4-methylphenyl)methyl]-3H-purin-6-one Traditional Name: 2-(methylaminomethyl)-7-(4-methylbenzyl)-3H-purin-6-one Formula: C15H17N5O MolecularWeight: 283.32838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)CNC

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)CNC

InChI

InChI=1S/C15H17N5O/c1-10-3-5-11(6-4-10)8-20-9-17-14-13(20)15(21)19-12(18-14)7-16-2/h3-6,9,16H,7-8H2,1-2H3,(H,18,19,21)