N-[1-(4-bromophenyl)ethyl]-2-chloranyl-9-propan-2-yl-purin-6-amine

Systemtic Name: N-[1-(4-bromophenyl)ethyl]-2-chloranyl-9-propan-2-yl-purin-6-amine Openeye Name: N-[1-(4-bromophenyl)ethyl]-2-chloro-9-isopropyl-purin-6-amine CAS Name: N-[1-(4-bromophenyl)ethyl]-2-chloro-9-propan-2-yl-6-purinamine IUPAC Name: N-[1-(4-bromophenyl)ethyl]-2-chloro-9-propan-2-ylpurin-6-amine Traditional Name: 1-(4-bromophenyl)ethyl-(2-chloro-9-isopropyl-purin-6-yl)amine Formula: C16H17BrClN5 MolecularWeight: 394.69668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NC(C)C3=CC=C(C=C3)Br)Cl

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NC(C)C3=CC=C(C=C3)Br)Cl

InChI

InChI=1S/C16H17BrClN5/c1-9(2)23-8-19-13-14(21-16(18)22-15(13)23)20-10(3)11-4-6-12(17)7-5-11/h4-10H,1-3H3,(H,20,21,22)