9-(2-methylpropyl)-6-propylsulfanyl-purin-2-amine

Systemtic Name: 9-(2-methylpropyl)-6-propylsulfanyl-purin-2-amine Openeye Name: 9-isobutyl-6-propylsulfanyl-purin-2-amine CAS Name: 9-(2-methylpropyl)-6-(propylthio)-2-purinamine IUPAC Name: 9-(2-methylpropyl)-6-propylsulfanylpurin-2-amine Traditional Name: [9-isobutyl-6-(propylthio)purin-2-yl]amine Formula: C12H19N5S MolecularWeight: 265.37776

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=NC2=C1N=CN2CC(C)C)N

Isomeric SMILES

CCCSC1=NC(=NC2=C1N=CN2CC(C)C)N

InChI

InChI=1S/C12H19N5S/c1-4-5-18-11-9-10(15-12(13)16-11)17(7-14-9)6-8(2)3/h7-8H,4-6H2,1-3H3,(H2,13,15,16)