4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)butanamide

Systemtic Name: 4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)butanamide Openeye Name: 4-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)butanamide CAS Name: 4-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(3,5-dimethyl-1-phenyl-4-pyrazolyl)butanamide IUPAC Name: 4-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(3,5-dimethyl-1-phenylpyrazol-4-yl)butanamide Traditional Name: 4-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)butyramide Formula: C22H25N7O3 MolecularWeight: 435.479

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CCCN3C=NC4=C3C(=O)N(C(=O)N4C)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CCCN3C=NC4=C3C(=O)N(C(=O)N4C)C

InChI

InChI=1S/C22H25N7O3/c1-14-18(15(2)29(25-14)16-9-6-5-7-10-16)24-17(30)11-8-12-28-13-23-20-19(28)21(31)27(4)22(32)26(20)3/h5-7,9-10,13H,8,11-12H2,1-4H3,(H,24,30)