[(2S)-1-[(5-methyl-6-oxidanylidene-7H-benzo[d][1]benzazepin-7-yl)amino]-1-oxidanylidene-propan-2-yl] N-[[2-fluoranyl-5-(trifluoromethyl)phenyl]methyl]carbamate

Systemtic Name: [(2S)-1-[(5-methyl-6-oxidanylidene-7H-benzo[d][1]benzazepin-7-yl)amino]-1-oxidanylidene-propan-2-yl] N-[[2-fluoranyl-5-(trifluoromethyl)phenyl]methyl]carbamate Openeye Name: [(1S)-1-methyl-2-[(5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl)amino]-2-oxo-ethyl] N-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]carbamate CAS Name: N-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]carbamic acid [(2S)-1-[(5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-[(5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl)amino]-1-oxopropan-2-yl] N-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]carbamate Traditional Name: N-[2-fluoro-5-(trifluoromethyl)benzyl]carbamic acid [(1S)-2-keto-2-[(6-keto-5-methyl-7H-benzo[d][1]benzazepin-7-yl)amino]-1-methyl-ethyl] ester Formula: C27H23F4N3O4 MolecularWeight: 529.482833

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1C2=CC=CC=C2C3=CC=CC=C3N(C1=O)C)OC(=O)NCC4=C(C=CC(=C4)C(F)(F)F)F

Isomeric SMILES

C[C@@H](C(=O)NC1C2=CC=CC=C2C3=CC=CC=C3N(C1=O)C)OC(=O)NCC4=C(C=CC(=C4)C(F)(F)F)F

InChI

InChI=1S/C27H23F4N3O4/c1-15(38-26(37)32-14-16-13-17(27(29,30)31)11-12-21(16)28)24(35)33-23-20-9-4-3-7-18(20)19-8-5-6-10-22(19)34(2)25(23)36/h3-13,15,23H,14H2,1-2H3,(H,32,37)(H,33,35)/t15-,23?/m0/s1