(3R,7R)-4-[(3R)-3-azanyl-4-[2,4,5-tris(fluoranyl)phenyl]butanoyl]-7-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]-1,4-diazepan-2-one

Systemtic Name: (3R,7R)-4-[(3R)-3-azanyl-4-[2,4,5-tris(fluoranyl)phenyl]butanoyl]-7-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]-1,4-diazepan-2-one Openeye Name: (3R,7R)-4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-7-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]-1,4-diazepan-2-one CAS Name: (3R,7R)-4-[(3R)-3-amino-1-oxo-4-(2,4,5-trifluorophenyl)butyl]-7-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]-1,4-diazepan-2-one IUPAC Name: (3R,7R)-4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-7-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]-1,4-diazepan-2-one Traditional Name: (3R,7R)-4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-7-methyl-3-[2-(trifluoromethyl)benzyl]-1,4-diazepan-2-one Formula: C24H25F6N3O2 MolecularWeight: 501.464619

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C(C(=O)N1)CC2=CC=CC=C2C(F)(F)F)C(=O)CC(CC3=CC(=C(C=C3F)F)F)N

Isomeric SMILES

C[C@@H]1CCN([C@@H](C(=O)N1)CC2=CC=CC=C2C(F)(F)F)C(=O)C[C@@H](CC3=CC(=C(C=C3F)F)F)N

InChI

InChI=1S/C24H25F6N3O2/c1-13-6-7-33(22(34)11-16(31)8-15-9-19(26)20(27)12-18(15)25)21(23(35)32-13)10-14-4-2-3-5-17(14)24(28,29)30/h2-5,9,12-13,16,21H,6-8,10-11,31H2,1H3,(H,32,35)/t13-,16-,21-/m1/s1