7-(3-methylbutyl)-6-methylsulfanyl-purin-2-amine

Systemtic Name: 7-(3-methylbutyl)-6-methylsulfanyl-purin-2-amine Openeye Name: 7-isopentyl-6-methylsulfanyl-purin-2-amine CAS Name: 7-(3-methylbutyl)-6-(methylthio)-2-purinamine IUPAC Name: 7-(3-methylbutyl)-6-methylsulfanylpurin-2-amine Traditional Name: [7-isoamyl-6-(methylthio)purin-2-yl]amine Formula: C11H17N5S MolecularWeight: 251.35118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=NC2=C1C(=NC(=N2)N)SC

Isomeric SMILES

CC(C)CCN1C=NC2=C1C(=NC(=N2)N)SC

InChI

InChI=1S/C11H17N5S/c1-7(2)4-5-16-6-13-9-8(16)10(17-3)15-11(12)14-9/h6-7H,4-5H2,1-3H3,(H2,12,14,15)