6-[(2-chlorophenyl)methylsulfanyl]-3-methyl-purin-2-amine

Systemtic Name: 6-[(2-chlorophenyl)methylsulfanyl]-3-methyl-purin-2-amine Openeye Name: 6-[(2-chlorophenyl)methylsulfanyl]-3-methyl-purin-2-amine CAS Name: 6-[(2-chlorophenyl)methylthio]-3-methyl-2-purinamine IUPAC Name: 6-[(2-chlorophenyl)methylsulfanyl]-3-methylpurin-2-amine Traditional Name: [6-[(2-chlorobenzyl)thio]-3-methyl-purin-2-yl]amine Formula: C13H12ClN5S MolecularWeight: 305.78588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC=NC2=C(N=C1N)SCC3=CC=CC=C3Cl

Isomeric SMILES

CN1C2=NC=NC2=C(N=C1N)SCC3=CC=CC=C3Cl

InChI

InChI=1S/C13H12ClN5S/c1-19-11-10(16-7-17-11)12(18-13(19)15)20-6-8-4-2-3-5-9(8)14/h2-5,7H,6H2,1H3,(H2,15,18)