N-[4-(azepan-1-yl)phenyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]ethanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]ethanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide CAS Name: N-[4-(1-azepanyl)phenyl]-2-[3-(trifluoromethyl)-1-pyrazolyl]acetamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide Formula: C18H21F3N4O MolecularWeight: 366.38075

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CN3C=CC(=N3)C(F)(F)F

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CN3C=CC(=N3)C(F)(F)F

InChI

InChI=1S/C18H21F3N4O/c19-18(20,21)16-9-12-25(23-16)13-17(26)22-14-5-7-15(8-6-14)24-10-3-1-2-4-11-24/h5-9,12H,1-4,10-11,13H2,(H,22,26)