4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(2-propan-2-ylpyrazol-3-yl)butanamide

Systemtic Name: 4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(2-propan-2-ylpyrazol-3-yl)butanamide Openeye Name: 4-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(2-isopropylpyrazol-3-yl)butanamide CAS Name: 4-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(2-propan-2-yl-3-pyrazolyl)butanamide IUPAC Name: 4-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(2-propan-2-ylpyrazol-3-yl)butanamide Traditional Name: 4-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(2-isopropylpyrazol-3-yl)butyramide Formula: C17H23N7O3 MolecularWeight: 373.40962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CC=N1)NC(=O)CCCN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC(C)N1C(=CC=N1)NC(=O)CCCN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C17H23N7O3/c1-11(2)24-12(7-8-19-24)20-13(25)6-5-9-23-10-18-15-14(23)16(26)22(4)17(27)21(15)3/h7-8,10-11H,5-6,9H2,1-4H3,(H,20,25)