3-[methyl(7H-purin-6-yl)amino]propanethioamide

Systemtic Name: 3-[methyl(7H-purin-6-yl)amino]propanethioamide Openeye Name: 3-[methyl(7H-purin-6-yl)amino]propanethioamide CAS Name: 3-[methyl(7H-purin-6-yl)amino]propanethioamide IUPAC Name: 3-[methyl(7H-purin-6-yl)amino]propanethioamide Traditional Name: 3-[methyl(7H-purin-6-yl)amino]thiopropionamide Formula: C9H12N6S MolecularWeight: 236.29678

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=S)N)C1=NC=NC2=C1NC=N2

Isomeric SMILES

CN(CCC(=S)N)C1=NC=NC2=C1NC=N2

InChI

InChI=1S/C9H12N6S/c1-15(3-2-6(10)16)9-7-8(12-4-11-7)13-5-14-9/h4-5H,2-3H2,1H3,(H2,10,16)(H,11,12,13,14)