2-[2-[3,5-bis(fluoranyl)phenyl]ethanoylamino]-N-(7-cyclohexyl-6-oxidanylidene-7H-benzo[d][1]benzazepin-5-yl)propanamide

Systemtic Name: 2-[2-[3,5-bis(fluoranyl)phenyl]ethanoylamino]-N-(7-cyclohexyl-6-oxidanylidene-7H-benzo[d][1]benzazepin-5-yl)propanamide Openeye Name: N-(7-cyclohexyl-6-oxo-7H-benzo[d][1]benzazepin-5-yl)-2-[[2-(3,5-difluorophenyl)acetyl]amino]propanamide CAS Name: N-(7-cyclohexyl-6-oxo-7H-benzo[d][1]benzazepin-5-yl)-2-[[2-(3,5-difluorophenyl)-1-oxoethyl]amino]propanamide IUPAC Name: N-(7-cyclohexyl-6-oxo-7H-benzo[d][1]benzazepin-5-yl)-2-[[2-(3,5-difluorophenyl)acetyl]amino]propanamide Traditional Name: N-(7-cyclohexyl-6-keto-7H-benzo[d][1]benzazepin-5-yl)-2-[[2-(3,5-difluorophenyl)acetyl]amino]propionamide Formula: C31H31F2N3O3 MolecularWeight: 531.592946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN1C2=CC=CC=C2C3=CC=CC=C3C(C1=O)C4CCCCC4)NC(=O)CC5=CC(=CC(=C5)F)F

Isomeric SMILES

CC(C(=O)NN1C2=CC=CC=C2C3=CC=CC=C3C(C1=O)C4CCCCC4)NC(=O)CC5=CC(=CC(=C5)F)F

InChI

InChI=1S/C31H31F2N3O3/c1-19(34-28(37)17-20-15-22(32)18-23(33)16-20)30(38)35-36-27-14-8-7-12-25(27)24-11-5-6-13-26(24)29(31(36)39)21-9-3-2-4-10-21/h5-8,11-16,18-19,21,29H,2-4,9-10,17H2,1H3,(H,34,37)(H,35,38)