(3R,5S)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3,5-dimethyl-adamantane-1-carboxamide

Systemtic Name: (3R,5S)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3,5-dimethyl-adamantane-1-carboxamide Openeye Name: (3R,5S)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3,5-dimethyl-adamantane-1-carboxamide CAS Name: (3R,5S)-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3,5-dimethyl-1-adamantanecarboxamide IUPAC Name: (3R,5S)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3,5-dimethyladamantane-1-carboxamide Traditional Name: (3R,5S)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3,5-dimethyl-adamantane-1-carboxamide Formula: C24H31N3O2 MolecularWeight: 393.52184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C34CC5CC(C3)(CC(C5)(C4)C)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C34CC5C[C@@](C3)(C[C@](C5)(C4)C)C

InChI

InChI=1S/C24H31N3O2/c1-16-19(20(28)27(26(16)4)18-8-6-5-7-9-18)25-21(29)24-12-17-10-22(2,14-24)13-23(3,11-17)15-24/h5-9,17H,10-15H2,1-4H3,(H,25,29)/t17?,22-,23+,24?