3-(1-adamantyl)-1-phenyl-N-(3-pyrazol-1-ylpropyl)pyrazole-4-carboxamide

Systemtic Name: 3-(1-adamantyl)-1-phenyl-N-(3-pyrazol-1-ylpropyl)pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-1-phenyl-N-(3-pyrazol-1-ylpropyl)pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-1-phenyl-N-[3-(1-pyrazolyl)propyl]-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-1-phenyl-N-(3-pyrazol-1-ylpropyl)pyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-1-phenyl-N-(3-pyrazol-1-ylpropyl)pyrazole-4-carboxamide Formula: C26H31N5O MolecularWeight: 429.55724

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NN(C=C4C(=O)NCCCN5C=CC=N5)C6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NN(C=C4C(=O)NCCCN5C=CC=N5)C6=CC=CC=C6

InChI

InChI=1S/C26H31N5O/c32-25(27-8-4-10-30-11-5-9-28-30)23-18-31(22-6-2-1-3-7-22)29-24(23)26-15-19-12-20(16-26)14-21(13-19)17-26/h1-3,5-7,9,11,18-21H,4,8,10,12-17H2,(H,27,32)