2-chloranyl-N-phenethyl-9-phenyl-purin-6-amine hydrochloride

Systemtic Name: 2-chloranyl-N-phenethyl-9-phenyl-purin-6-amine hydrochloride Openeye Name: 2-chloro-N-phenethyl-9-phenyl-purin-6-amine hydrochloride CAS Name: 2-chloro-N-phenethyl-9-phenyl-6-purinamine hydrochloride IUPAC Name: 2-chloro-N-phenethyl-9-phenylpurin-6-amine hydrochloride Traditional Name: (2-chloro-9-phenyl-purin-6-yl)-phenethyl-amine hydrochloride Formula: C19H17Cl2N5 MolecularWeight: 386.27778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=NC(=NC3=C2N=CN3C4=CC=CC=C4)Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=NC(=NC3=C2N=CN3C4=CC=CC=C4)Cl.Cl

InChI

InChI=1S/C19H16ClN5.ClH/c20-19-23-17(21-12-11-14-7-3-1-4-8-14)16-18(24-19)25(13-22-16)15-9-5-2-6-10-15;/h1-10,13H,11-12H2,(H,21,23,24);1H