5-oxidanylidene-2-phenyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-4-carboxamide

Systemtic Name: 5-oxidanylidene-2-phenyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-4-carboxamide Openeye Name: 5-oxo-2-phenyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-4-carboxamide CAS Name: 5-oxo-2-phenyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-4-carboxamide IUPAC Name: 5-oxo-2-phenyl-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyrazole-4-carboxamide Traditional Name: 3-keto-1-phenyl-N-(3,3,5,5-tetramethylcyclohexyl)-3-pyrazoline-4-carboxamide Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)(C)C)NC(=O)C2=CN(NC2=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CC(CC(C1)(C)C)NC(=O)C2=CN(NC2=O)C3=CC=CC=C3)C

InChI

InChI=1S/C20H27N3O2/c1-19(2)10-14(11-20(3,4)13-19)21-17(24)16-12-23(22-18(16)25)15-8-6-5-7-9-15/h5-9,12,14H,10-11,13H2,1-4H3,(H,21,24)(H,22,25)