9-(3-chloranylpropyl)-6-methylsulfanyl-purin-2-amine

Systemtic Name: 9-(3-chloranylpropyl)-6-methylsulfanyl-purin-2-amine Openeye Name: 9-(3-chloropropyl)-6-methylsulfanyl-purin-2-amine CAS Name: 9-(3-chloropropyl)-6-(methylthio)-2-purinamine IUPAC Name: 9-(3-chloropropyl)-6-methylsulfanylpurin-2-amine Traditional Name: [9-(3-chloropropyl)-6-(methylthio)purin-2-yl]amine Formula: C9H12ClN5S MolecularWeight: 257.74308

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC2=C1N=CN2CCCCl)N

Isomeric SMILES

CSC1=NC(=NC2=C1N=CN2CCCCl)N

InChI

InChI=1S/C9H12ClN5S/c1-16-8-6-7(13-9(11)14-8)15(5-12-6)4-2-3-10/h5H,2-4H2,1H3,(H2,11,13,14)