3-(1-adamantyl)-N-(2-adamantyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(1-adamantyl)-N-(2-adamantyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-(2-adamantyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-(2-adamantyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-(2-adamantyl)-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-(2-adamantyl)-1-phenyl-pyrazole-4-carboxamide Formula: C30H37N3O MolecularWeight: 455.63428

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)C4=CN(N=C4C56CC7CC(C5)CC(C7)C6)C8=CC=CC=C8

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)C4=CN(N=C4C56CC7CC(C5)CC(C7)C6)C8=CC=CC=C8

InChI

InChI=1S/C30H37N3O/c34-29(31-27-23-10-18-6-19(12-23)13-24(27)11-18)26-17-33(25-4-2-1-3-5-25)32-28(26)30-14-20-7-21(15-30)9-22(8-20)16-30/h1-5,17-24,27H,6-16H2,(H,31,34)