6-[(2-chlorophenyl)methylsulfanyl]-7H-purin-2-amine

Systemtic Name: 6-[(2-chlorophenyl)methylsulfanyl]-7H-purin-2-amine Openeye Name: 6-[(2-chlorophenyl)methylsulfanyl]-7H-purin-2-amine CAS Name: 6-[(2-chlorophenyl)methylthio]-7H-purin-2-amine IUPAC Name: 6-[(2-chlorophenyl)methylsulfanyl]-7H-purin-2-amine Traditional Name: [6-[(2-chlorobenzyl)thio]-7H-purin-2-yl]amine Formula: C12H10ClN5S MolecularWeight: 291.7593

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC(=NC3=C2NC=N3)N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC(=NC3=C2NC=N3)N)Cl

InChI

InChI=1S/C12H10ClN5S/c13-8-4-2-1-3-7(8)5-19-11-9-10(16-6-15-9)17-12(14)18-11/h1-4,6H,5H2,(H3,14,15,16,17,18)