N-[1-[1-cyclopropyl-3-ethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]pyrazol-4-yl]-N-methyl-pyridine-3-carboxamide

Systemtic Name: N-[1-[1-cyclopropyl-3-ethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]pyrazol-4-yl]-N-methyl-pyridine-3-carboxamide Openeye Name: N-[1-(1-cyclopropyl-3-ethyl-2,6-dioxo-7H-purin-8-yl)pyrazol-4-yl]-N-methyl-pyridine-3-carboxamide CAS Name: N-[1-(1-cyclopropyl-3-ethyl-2,6-dioxo-7H-purin-8-yl)-4-pyrazolyl]-N-methyl-3-pyridinecarboxamide IUPAC Name: N-[1-(1-cyclopropyl-3-ethyl-2,6-dioxo-7H-purin-8-yl)pyrazol-4-yl]-N-methylpyridine-3-carboxamide Traditional Name: N-[1-(1-cyclopropyl-3-ethyl-2,6-diketo-7H-purin-8-yl)pyrazol-4-yl]-N-methyl-nicotinamide Formula: C20H20N8O3 MolecularWeight: 420.4246

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N(C1=O)C3CC3)NC(=N2)N4C=C(C=N4)N(C)C(=O)C5=CN=CC=C5

Isomeric SMILES

CCN1C2=C(C(=O)N(C1=O)C3CC3)NC(=N2)N4C=C(C=N4)N(C)C(=O)C5=CN=CC=C5

InChI

InChI=1S/C20H20N8O3/c1-3-26-16-15(18(30)28(20(26)31)13-6-7-13)23-19(24-16)27-11-14(10-22-27)25(2)17(29)12-5-4-8-21-9-12/h4-5,8-11,13H,3,6-7H2,1-2H3,(H,23,24)