2-(2,4-dichlorophenyl)-7-(phenylmethyl)-3H-purin-6-one

Systemtic Name: 2-(2,4-dichlorophenyl)-7-(phenylmethyl)-3H-purin-6-one Openeye Name: 7-benzyl-2-(2,4-dichlorophenyl)-3H-purin-6-one CAS Name: 2-(2,4-dichlorophenyl)-7-(phenylmethyl)-3H-purin-6-one IUPAC Name: 7-benzyl-2-(2,4-dichlorophenyl)-3H-purin-6-one Traditional Name: 7-benzyl-2-(2,4-dichlorophenyl)-3H-purin-6-one Formula: C18H12Cl2N4O MolecularWeight: 371.22008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12Cl2N4O/c19-12-6-7-13(14(20)8-12)16-22-17-15(18(25)23-16)24(10-21-17)9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H,22,23,25)