N-[3-azanyl-2-oxidanylidene-5-phenyl-7-[4-(trifluoromethyl)phenyl]azepan-1-yl]-N-tert-butyl-ethanamide

Systemtic Name: N-[3-azanyl-2-oxidanylidene-5-phenyl-7-[4-(trifluoromethyl)phenyl]azepan-1-yl]-N-tert-butyl-ethanamide Openeye Name: N-[3-amino-2-oxo-5-phenyl-7-[4-(trifluoromethyl)phenyl]azepan-1-yl]-N-tert-butyl-acetamide CAS Name: N-[3-amino-2-oxo-5-phenyl-7-[4-(trifluoromethyl)phenyl]-1-azepanyl]-N-tert-butylacetamide IUPAC Name: N-[3-amino-2-oxo-5-phenyl-7-[4-(trifluoromethyl)phenyl]azepan-1-yl]-N-tert-butylacetamide Traditional Name: N-[3-amino-2-keto-5-phenyl-7-[4-(trifluoromethyl)phenyl]azepan-1-yl]-N-tert-butyl-acetamide Formula: C25H30F3N3O2 MolecularWeight: 461.51981

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C(C)(C)C)N1C(CC(CC(C1=O)N)C2=CC=CC=C2)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(=O)N(C(C)(C)C)N1C(CC(CC(C1=O)N)C2=CC=CC=C2)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C25H30F3N3O2/c1-16(32)31(24(2,3)4)30-22(18-10-12-20(13-11-18)25(26,27)28)15-19(14-21(29)23(30)33)17-8-6-5-7-9-17/h5-13,19,21-22H,14-15,29H2,1-4H3