N-(phenylmethyl)-7H-purin-6-amine hydrochloride

Systemtic Name: N-(phenylmethyl)-7H-purin-6-amine hydrochloride Openeye Name: N-benzyl-7H-purin-6-amine hydrochloride CAS Name: N-(phenylmethyl)-7H-purin-6-amine hydrochloride IUPAC Name: N-benzyl-7H-purin-6-amine hydrochloride Traditional Name: benzyl(7H-purin-6-yl)amine hydrochloride Formula: C12H12ClN5 MolecularWeight: 261.71018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11N5.ClH/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11;/h1-5,7-8H,6H2,(H2,13,14,15,16,17);1H