2-(methylaminomethyl)-7-(3-phenylpropyl)-3H-purin-6-one

Systemtic Name: 2-(methylaminomethyl)-7-(3-phenylpropyl)-3H-purin-6-one Openeye Name: 2-(methylaminomethyl)-7-(3-phenylpropyl)-3H-purin-6-one CAS Name: 2-(methylaminomethyl)-7-(3-phenylpropyl)-3H-purin-6-one IUPAC Name: 2-(methylaminomethyl)-7-(3-phenylpropyl)-3H-purin-6-one Traditional Name: 2-(methylaminomethyl)-7-(3-phenylpropyl)-3H-purin-6-one Formula: C16H19N5O MolecularWeight: 297.35496

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=NC(=O)C2=C(N1)N=CN2CCCC3=CC=CC=C3

Isomeric SMILES

CNCC1=NC(=O)C2=C(N1)N=CN2CCCC3=CC=CC=C3

InChI

InChI=1S/C16H19N5O/c1-17-10-13-19-15-14(16(22)20-13)21(11-18-15)9-5-8-12-6-3-2-4-7-12/h2-4,6-7,11,17H,5,8-10H2,1H3,(H,19,20,22)