2-[8-(3,5-dimethylpyrazol-1-yl)-3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]ethanamide

Systemtic Name: 2-[8-(3,5-dimethylpyrazol-1-yl)-3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]ethanamide Openeye Name: 2-[8-(3,5-dimethylpyrazol-1-yl)-3,7-dimethyl-2,6-dioxo-purin-1-yl]acetamide CAS Name: 2-[8-(3,5-dimethyl-1-pyrazolyl)-3,7-dimethyl-2,6-dioxo-1-purinyl]acetamide IUPAC Name: 2-[8-(3,5-dimethylpyrazol-1-yl)-3,7-dimethyl-2,6-dioxopurin-1-yl]acetamide Traditional Name: 2-[8-(3,5-dimethylpyrazol-1-yl)-2,6-diketo-3,7-dimethyl-purin-1-yl]acetamide Formula: C14H17N7O3 MolecularWeight: 331.32988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC3=C(N2C)C(=O)N(C(=O)N3C)CC(=O)N)C

Isomeric SMILES

CC1=CC(=NN1C2=NC3=C(N2C)C(=O)N(C(=O)N3C)CC(=O)N)C

InChI

InChI=1S/C14H17N7O3/c1-7-5-8(2)21(17-7)13-16-11-10(18(13)3)12(23)20(6-9(15)22)14(24)19(11)4/h5H,6H2,1-4H3,(H2,15,22)