3-(1-adamantyl)-N-[(4-fluorophenyl)methyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(1-adamantyl)-N-[(4-fluorophenyl)methyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-[(4-fluorophenyl)methyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-[(4-fluorophenyl)methyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-[(4-fluorophenyl)methyl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-(4-fluorobenzyl)-1-phenyl-pyrazole-4-carboxamide Formula: C27H28FN3O MolecularWeight: 429.529123

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NN(C=C4C(=O)NCC5=CC=C(C=C5)F)C6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NN(C=C4C(=O)NCC5=CC=C(C=C5)F)C6=CC=CC=C6

InChI

InChI=1S/C27H28FN3O/c28-22-8-6-18(7-9-22)16-29-26(32)24-17-31(23-4-2-1-3-5-23)30-25(24)27-13-19-10-20(14-27)12-21(11-19)15-27/h1-9,17,19-21H,10-16H2,(H,29,32)