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

Systemtic Name: N-[2-(6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-(furan-2-yl)pyrazol-3-yl]adamantane-1-carboxamide Openeye Name: N-[2-(6-ethyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-furyl)pyrazol-3-yl]adamantane-1-carboxamide CAS Name: N-[2-(6-ethyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-furanyl)-3-pyrazolyl]-1-adamantanecarboxamide IUPAC Name: N-[2-(6-ethyl-4-oxo-1H-pyrimidin-2-yl)-5-(furan-2-yl)pyrazol-3-yl]adamantane-1-carboxamide Traditional Name: N-[2-(6-ethyl-4-keto-1H-pyrimidin-2-yl)-5-(2-furyl)pyrazol-3-yl]adamantane-1-carboxamide Formula: C24H27N5O3 MolecularWeight: 433.50288

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CO3)NC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCC1=CC(=O)N=C(N1)N2C(=CC(=N2)C3=CC=CO3)NC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C24H27N5O3/c1-2-17-9-21(30)27-23(25-17)29-20(10-18(28-29)19-4-3-5-32-19)26-22(31)24-11-14-6-15(12-24)8-16(7-14)13-24/h3-5,9-10,14-16H,2,6-8,11-13H2,1H3,(H,26,31)(H,25,27,30)