N-[2-(azepan-1-yl)-5-(trifluoromethyl)phenyl]-2-pyrazol-1-yl-propanamide

Systemtic Name: N-[2-(azepan-1-yl)-5-(trifluoromethyl)phenyl]-2-pyrazol-1-yl-propanamide Openeye Name: N-[2-(azepan-1-yl)-5-(trifluoromethyl)phenyl]-2-pyrazol-1-yl-propanamide CAS Name: N-[2-(1-azepanyl)-5-(trifluoromethyl)phenyl]-2-(1-pyrazolyl)propanamide IUPAC Name: N-[2-(azepan-1-yl)-5-(trifluoromethyl)phenyl]-2-pyrazol-1-ylpropanamide Traditional Name: N-[2-(azepan-1-yl)-5-(trifluoromethyl)phenyl]-2-pyrazol-1-yl-propionamide Formula: C19H23F3N4O MolecularWeight: 380.40733

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)C(F)(F)F)N2CCCCCC2)N3C=CC=N3

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)C(F)(F)F)N2CCCCCC2)N3C=CC=N3

InChI

InChI=1S/C19H23F3N4O/c1-14(26-12-6-9-23-26)18(27)24-16-13-15(19(20,21)22)7-8-17(16)25-10-4-2-3-5-11-25/h6-9,12-14H,2-5,10-11H2,1H3,(H,24,27)