9-[(2-chlorophenyl)methyl]-8-methylsulfanyl-purin-6-amine

Systemtic Name: 9-[(2-chlorophenyl)methyl]-8-methylsulfanyl-purin-6-amine Openeye Name: 9-[(2-chlorophenyl)methyl]-8-methylsulfanyl-purin-6-amine CAS Name: 9-[(2-chlorophenyl)methyl]-8-(methylthio)-6-purinamine IUPAC Name: 9-[(2-chlorophenyl)methyl]-8-methylsulfanylpurin-6-amine Traditional Name: [9-(2-chlorobenzyl)-8-(methylthio)purin-6-yl]amine Formula: C13H12ClN5S MolecularWeight: 305.78588

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(N1CC3=CC=CC=C3Cl)N=CN=C2N

Isomeric SMILES

CSC1=NC2=C(N1CC3=CC=CC=C3Cl)N=CN=C2N

InChI

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