N-tert-butyl-N-[2-oxidanylidene-5,7-diphenyl-3-[[3-(trifluoromethyl)phenyl]carbamoylamino]azepan-1-yl]ethanamide

Systemtic Name: N-tert-butyl-N-[2-oxidanylidene-5,7-diphenyl-3-[[3-(trifluoromethyl)phenyl]carbamoylamino]azepan-1-yl]ethanamide Openeye Name: N-tert-butyl-N-[2-oxo-5,7-diphenyl-3-[[3-(trifluoromethyl)phenyl]carbamoylamino]azepan-1-yl]acetamide CAS Name: N-tert-butyl-N-[2-oxo-3-[[oxo-[3-(trifluoromethyl)anilino]methyl]amino]-5,7-diphenyl-1-azepanyl]acetamide IUPAC Name: N-tert-butyl-N-[2-oxo-5,7-diphenyl-3-[[3-(trifluoromethyl)phenyl]carbamoylamino]azepan-1-yl]acetamide Traditional Name: N-tert-butyl-N-[2-keto-5,7-diphenyl-3-[[3-(trifluoromethyl)phenyl]carbamoylamino]azepan-1-yl]acetamide Formula: C32H35F3N4O3 MolecularWeight: 580.64051

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C(C)(C)C)N1C(CC(CC(C1=O)NC(=O)NC2=CC=CC(=C2)C(F)(F)F)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N(C(C)(C)C)N1C(CC(CC(C1=O)NC(=O)NC2=CC=CC(=C2)C(F)(F)F)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C32H35F3N4O3/c1-21(40)39(31(2,3)4)38-28(23-14-9-6-10-15-23)19-24(22-12-7-5-8-13-22)18-27(29(38)41)37-30(42)36-26-17-11-16-25(20-26)32(33,34)35/h5-17,20,24,27-28H,18-19H2,1-4H3,(H2,36,37,42)