N-(6-azanyl-9-ethyl-8-pyrazol-1-yl-purin-2-yl)-2-methoxy-ethanamide

Systemtic Name: N-(6-azanyl-9-ethyl-8-pyrazol-1-yl-purin-2-yl)-2-methoxy-ethanamide Openeye Name: N-(6-amino-9-ethyl-8-pyrazol-1-yl-purin-2-yl)-2-methoxy-acetamide CAS Name: N-[6-amino-9-ethyl-8-(1-pyrazolyl)-2-purinyl]-2-methoxyacetamide IUPAC Name: N-(6-amino-9-ethyl-8-pyrazol-1-ylpurin-2-yl)-2-methoxyacetamide Traditional Name: N-(6-amino-9-ethyl-8-pyrazol-1-yl-purin-2-yl)-2-methoxy-acetamide Formula: C13H16N8O2 MolecularWeight: 316.31854

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=NC(=N2)NC(=O)COC)N)N=C1N3C=CC=N3

Isomeric SMILES

CCN1C2=C(C(=NC(=N2)NC(=O)COC)N)N=C1N3C=CC=N3

InChI

InChI=1S/C13H16N8O2/c1-3-20-11-9(17-13(20)21-6-4-5-15-21)10(14)18-12(19-11)16-8(22)7-23-2/h4-6H,3,7H2,1-2H3,(H3,14,16,18,19,22)