N-(4-chloranylbutyl)-N-(6-methylsulfanylpurin-9-yl)ethanamide

Systemtic Name: N-(4-chloranylbutyl)-N-(6-methylsulfanylpurin-9-yl)ethanamide Openeye Name: N-(4-chlorobutyl)-N-(6-methylsulfanylpurin-9-yl)acetamide CAS Name: N-(4-chlorobutyl)-N-[6-(methylthio)-9-purinyl]acetamide IUPAC Name: N-(4-chlorobutyl)-N-(6-methylsulfanylpurin-9-yl)acetamide Traditional Name: N-(4-chlorobutyl)-N-[6-(methylthio)purin-9-yl]acetamide Formula: C12H16ClN5OS MolecularWeight: 313.80634

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CCCCCl)N1C=NC2=C1N=CN=C2SC

Isomeric SMILES

CC(=O)N(CCCCCl)N1C=NC2=C1N=CN=C2SC

InChI

InChI=1S/C12H16ClN5OS/c1-9(19)17(6-4-3-5-13)18-8-16-10-11(18)14-7-15-12(10)20-2/h7-8H,3-6H2,1-2H3