N-(3-imidazol-1-ylpropyl)-1-[[3-(trifluoromethyl)phenoxy]methyl]pyrazole-3-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-1-[[3-(trifluoromethyl)phenoxy]methyl]pyrazole-3-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-1-[[3-(trifluoromethyl)phenoxy]methyl]pyrazole-3-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-1-[[3-(trifluoromethyl)phenoxy]methyl]-3-pyrazolecarboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-1-[[3-(trifluoromethyl)phenoxy]methyl]pyrazole-3-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-1-[[3-(trifluoromethyl)phenoxy]methyl]pyrazole-3-carboxamide Formula: C18H18F3N5O2 MolecularWeight: 393.36303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCN2C=CC(=N2)C(=O)NCCCN3C=CN=C3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)OCN2C=CC(=N2)C(=O)NCCCN3C=CN=C3)C(F)(F)F

InChI

InChI=1S/C18H18F3N5O2/c19-18(20,21)14-3-1-4-15(11-14)28-13-26-9-5-16(24-26)17(27)23-6-2-8-25-10-7-22-12-25/h1,3-5,7,9-12H,2,6,8,13H2,(H,23,27)