8-(3-chloranyl-4-phenethyl-phenyl)-7H-purin-6-amine

Systemtic Name: 8-(3-chloranyl-4-phenethyl-phenyl)-7H-purin-6-amine Openeye Name: 8-(3-chloro-4-phenethyl-phenyl)-7H-purin-6-amine CAS Name: 8-(3-chloro-4-phenethylphenyl)-7H-purin-6-amine IUPAC Name: 8-(3-chloro-4-phenethylphenyl)-7H-purin-6-amine Traditional Name: [8-(3-chloro-4-phenethyl-phenyl)-7H-purin-6-yl]amine Formula: C19H16ClN5 MolecularWeight: 349.81684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=C(C=C(C=C2)C3=NC4=C(N3)C(=NC=N4)N)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCC2=C(C=C(C=C2)C3=NC4=C(N3)C(=NC=N4)N)Cl

InChI

InChI=1S/C19H16ClN5/c20-15-10-14(18-24-16-17(21)22-11-23-19(16)25-18)9-8-13(15)7-6-12-4-2-1-3-5-12/h1-5,8-11H,6-7H2,(H3,21,22,23,24,25)