3-(1-adamantylcarbonyl)-N-(4-ethanoylphenyl)-4,5-dihydro-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(1-adamantylcarbonyl)-N-(4-ethanoylphenyl)-4,5-dihydro-1H-pyrazole-5-carboxamide Openeye Name: N-(4-acetylphenyl)-3-(adamantane-1-carbonyl)-4,5-dihydro-1H-pyrazole-5-carboxamide CAS Name: N-(4-acetylphenyl)-3-[1-adamantyl(oxo)methyl]-4,5-dihydro-1H-pyrazole-5-carboxamide IUPAC Name: N-(4-acetylphenyl)-3-(adamantane-1-carbonyl)-4,5-dihydro-1H-pyrazole-5-carboxamide Traditional Name: N-(4-acetylphenyl)-5-(adamantane-1-carbonyl)-2-pyrazoline-3-carboxamide Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=NN2)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=NN2)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H27N3O3/c1-13(27)17-2-4-18(5-3-17)24-22(29)20-9-19(25-26-20)21(28)23-10-14-6-15(11-23)8-16(7-14)12-23/h2-5,14-16,20,26H,6-12H2,1H3,(H,24,29)