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

Systemtic Name: 2-(3-aminophenyl)-7-[(3-chlorophenyl)methyl]-3H-purin-6-one Openeye Name: 2-(3-aminophenyl)-7-[(3-chlorophenyl)methyl]-3H-purin-6-one CAS Name: 2-(3-aminophenyl)-7-[(3-chlorophenyl)methyl]-3H-purin-6-one IUPAC Name: 2-(3-aminophenyl)-7-[(3-chlorophenyl)methyl]-3H-purin-6-one Traditional Name: 2-(3-aminophenyl)-7-(3-chlorobenzyl)-3H-purin-6-one Formula: C18H14ClN5O MolecularWeight: 351.78966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CN2C=NC3=C2C(=O)N=C(N3)C4=CC(=CC=C4)N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CN2C=NC3=C2C(=O)N=C(N3)C4=CC(=CC=C4)N

InChI

InChI=1S/C18H14ClN5O/c19-13-5-1-3-11(7-13)9-24-10-21-17-15(24)18(25)23-16(22-17)12-4-2-6-14(20)8-12/h1-8,10H,9,20H2,(H,22,23,25)