(E)-3-[2,4-bis(fluoranyl)phenyl]-N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]prop-2-enamide

Systemtic Name: (E)-3-[2,4-bis(fluoranyl)phenyl]-N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]prop-2-enamide Openeye Name: (E)-N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]-3-(2,4-difluorophenyl)prop-2-enamide CAS Name: (E)-N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]-3-(2,4-difluorophenyl)-2-propenamide IUPAC Name: (E)-N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]-3-(2,4-difluorophenyl)prop-2-enamide Traditional Name: (E)-N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]-3-(2,4-difluorophenyl)acrylamide Formula: C28H31F2N3O MolecularWeight: 463.562046

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CCN2CCC3=C(CC2)C=C(C=C3)C#N)NC(=O)C=CC4=C(C=C(C=C4)F)F

Isomeric SMILES

C1CC(CCC1CCN2CCC3=C(CC2)C=C(C=C3)C#N)NC(=O)/C=C/C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C28H31F2N3O/c29-25-7-5-23(27(30)18-25)6-10-28(34)32-26-8-2-20(3-9-26)11-14-33-15-12-22-4-1-21(19-31)17-24(22)13-16-33/h1,4-7,10,17-18,20,26H,2-3,8-9,11-16H2,(H,32,34)/b10-6+