2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(1-methylpyrazol-3-yl)ethanamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(1-methylpyrazol-3-yl)ethanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(1-methylpyrazol-3-yl)acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(1-methyl-3-pyrazolyl)acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(1-methylpyrazol-3-yl)acetamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(1-methylpyrazol-3-yl)acetamide Formula: C13H15N7O3 MolecularWeight: 317.3033

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CN1C=CC(=N1)NC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C13H15N7O3/c1-17-5-4-8(16-17)15-9(21)6-20-7-14-11-10(20)12(22)19(3)13(23)18(11)2/h4-5,7H,6H2,1-3H3,(H,15,16,21)