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

Systemtic Name: 7-[(3-chlorophenyl)methyl]-2-(methylaminomethyl)-3H-purin-6-one dihydrochloride Openeye Name: 7-[(3-chlorophenyl)methyl]-2-(methylaminomethyl)-3H-purin-6-one dihydrochloride CAS Name: 7-[(3-chlorophenyl)methyl]-2-(methylaminomethyl)-3H-purin-6-one dihydrochloride IUPAC Name: 7-[(3-chlorophenyl)methyl]-2-(methylaminomethyl)-3H-purin-6-one dihydrochloride Traditional Name: 7-(3-chlorobenzyl)-2-(methylaminomethyl)-3H-purin-6-one dihydrochloride Formula: C14H16Cl3N5O MolecularWeight: 376.66874

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=NC(=O)C2=C(N1)N=CN2CC3=CC(=CC=C3)Cl.Cl.Cl

Isomeric SMILES

CNCC1=NC(=O)C2=C(N1)N=CN2CC3=CC(=CC=C3)Cl.Cl.Cl

InChI

InChI=1S/C14H14ClN5O.2ClH/c1-16-6-11-18-13-12(14(21)19-11)20(8-17-13)7-9-3-2-4-10(15)5-9;;/h2-5,8,16H,6-7H2,1H3,(H,18,19,21);2*1H