9-(3,4-dichlorophenyl)-N-(4-phenoxyphenyl)purin-6-amine hydrochloride

Systemtic Name: 9-(3,4-dichlorophenyl)-N-(4-phenoxyphenyl)purin-6-amine hydrochloride Openeye Name: 9-(3,4-dichlorophenyl)-N-(4-phenoxyphenyl)purin-6-amine hydrochloride CAS Name: 9-(3,4-dichlorophenyl)-N-(4-phenoxyphenyl)-6-purinamine hydrochloride IUPAC Name: 9-(3,4-dichlorophenyl)-N-(4-phenoxyphenyl)purin-6-amine hydrochloride Traditional Name: [9-(3,4-dichlorophenyl)purin-6-yl]-(4-phenoxyphenyl)amine hydrochloride Formula: C23H16Cl3N5O MolecularWeight: 484.76504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC3=NC=NC4=C3N=CN4C5=CC(=C(C=C5)Cl)Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC3=NC=NC4=C3N=CN4C5=CC(=C(C=C5)Cl)Cl.Cl

InChI

InChI=1S/C23H15Cl2N5O.ClH/c24-19-11-8-16(12-20(19)25)30-14-28-21-22(26-13-27-23(21)30)29-15-6-9-18(10-7-15)31-17-4-2-1-3-5-17;/h1-14H,(H,26,27,29);1H