N-[5-(furan-2-yl)-2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]adamantane-1-carboxamide

Systemtic Name: N-[5-(furan-2-yl)-2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]adamantane-1-carboxamide Openeye Name: N-[5-(2-furyl)-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]adamantane-1-carboxamide CAS Name: N-[5-(2-furanyl)-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-3-pyrazolyl]-1-adamantanecarboxamide IUPAC Name: N-[5-(furan-2-yl)-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]adamantane-1-carboxamide Traditional Name: N-[5-(2-furyl)-2-(4-keto-6-methyl-1H-pyrimidin-2-yl)pyrazol-3-yl]adamantane-1-carboxamide Formula: C23H25N5O3 MolecularWeight: 419.4763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CO3)NC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CO3)NC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C23H25N5O3/c1-13-5-20(29)26-22(24-13)28-19(9-17(27-28)18-3-2-4-31-18)25-21(30)23-10-14-6-15(11-23)8-16(7-14)12-23/h2-5,9,14-16H,6-8,10-12H2,1H3,(H,25,30)(H,24,26,29)