N-[(3-chlorophenyl)methyl]-7H-purin-6-amine

Systemtic Name: N-[(3-chlorophenyl)methyl]-7H-purin-6-amine Openeye Name: N-[(3-chlorophenyl)methyl]-7H-purin-6-amine CAS Name: N-[(3-chlorophenyl)methyl]-7H-purin-6-amine IUPAC Name: N-[(3-chlorophenyl)methyl]-7H-purin-6-amine Traditional Name: (3-chlorobenzyl)-(7H-purin-6-yl)amine Formula: C12H10ClN5 MolecularWeight: 259.6943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CNC2=NC=NC3=C2NC=N3

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CNC2=NC=NC3=C2NC=N3

InChI

InChI=1S/C12H10ClN5/c13-9-3-1-2-8(4-9)5-14-11-10-12(16-6-15-10)18-7-17-11/h1-4,6-7H,5H2,(H2,14,15,16,17,18)