2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(2,5-dimethylpyrazol-3-yl)ethanamide

Systemtic Name: 2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(2,5-dimethylpyrazol-3-yl)ethanamide Openeye Name: 2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide CAS Name: 2-(3,7-dimethyl-2,6-dioxo-1-purinyl)-N-(2,5-dimethyl-3-pyrazolyl)acetamide IUPAC Name: 2-(3,7-dimethyl-2,6-dioxopurin-1-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide Traditional Name: 2-(2,6-diketo-3,7-dimethyl-purin-1-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide Formula: C14H17N7O3 MolecularWeight: 331.32988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CN2C(=O)C3=C(N=CN3C)N(C2=O)C)C

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CN2C(=O)C3=C(N=CN3C)N(C2=O)C)C

InChI

InChI=1S/C14H17N7O3/c1-8-5-9(20(4)17-8)16-10(22)6-21-13(23)11-12(15-7-18(11)2)19(3)14(21)24/h5,7H,6H2,1-4H3,(H,16,22)