N'-(1-adamantyl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)butanediamide

Systemtic Name: N'-(1-adamantyl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)butanediamide Openeye Name: N'-(1-adamantyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)butanediamide CAS Name: N'-(1-adamantyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)butanediamide IUPAC Name: N'-(1-adamantyl)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)butanediamide Traditional Name: N'-(1-adamantyl)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)succinamide Formula: C25H32N4O3 MolecularWeight: 436.54658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CCC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CCC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H32N4O3/c1-16-23(24(32)29(28(16)2)20-6-4-3-5-7-20)26-21(30)8-9-22(31)27-25-13-17-10-18(14-25)12-19(11-17)15-25/h3-7,17-19H,8-15H2,1-2H3,(H,26,30)(H,27,31)