2-[(2-azanyl-7H-purin-6-yl)sulfanyl]-N,N-diethyl-ethanamide

Systemtic Name: 2-[(2-azanyl-7H-purin-6-yl)sulfanyl]-N,N-diethyl-ethanamide Openeye Name: 2-[(2-amino-7H-purin-6-yl)sulfanyl]-N,N-diethyl-acetamide CAS Name: 2-[(2-amino-7H-purin-6-yl)thio]-N,N-diethylacetamide IUPAC Name: 2-[(2-amino-7H-purin-6-yl)sulfanyl]-N,N-diethylacetamide Traditional Name: 2-[(2-amino-7H-purin-6-yl)thio]-N,N-diethyl-acetamide Formula: C11H16N6OS MolecularWeight: 280.34934

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=NC(=NC2=C1NC=N2)N

Isomeric SMILES

CCN(CC)C(=O)CSC1=NC(=NC2=C1NC=N2)N

InChI

InChI=1S/C11H16N6OS/c1-3-17(4-2)7(18)5-19-10-8-9(14-6-13-8)15-11(12)16-10/h6H,3-5H2,1-2H3,(H3,12,13,14,15,16)