2-chloranyl-N-(phenylmethyl)-7H-purin-6-amine

Systemtic Name: 2-chloranyl-N-(phenylmethyl)-7H-purin-6-amine Openeye Name: N-benzyl-2-chloro-7H-purin-6-amine CAS Name: 2-chloro-N-(phenylmethyl)-7H-purin-6-amine IUPAC Name: N-benzyl-2-chloro-7H-purin-6-amine Traditional Name: benzyl-(2-chloro-7H-purin-6-yl)amine Formula: C12H10ClN5 MolecularWeight: 259.6943

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