(E)-3-(3-bromanyl-4-fluoranyl-phenyl)-N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-(3-bromanyl-4-fluoranyl-phenyl)-N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-3-(3-bromo-4-fluoro-phenyl)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-3-(3-bromo-4-fluorophenyl)-N-[5-chloro-2-(4-morpholinyl)phenyl]-2-cyano-2-propenamide IUPAC Name: (E)-3-(3-bromo-4-fluorophenyl)-N-(5-chloro-2-morpholin-4-ylphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-3-(3-bromo-4-fluoro-phenyl)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-acrylamide Formula: C20H16BrClFN3O2 MolecularWeight: 464.715343

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)Cl)NC(=O)C(=CC3=CC(=C(C=C3)F)Br)C#N

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)Cl)NC(=O)/C(=C/C3=CC(=C(C=C3)F)Br)/C#N

InChI

InChI=1S/C20H16BrClFN3O2/c21-16-10-13(1-3-17(16)23)9-14(12-24)20(27)25-18-11-15(22)2-4-19(18)26-5-7-28-8-6-26/h1-4,9-11H,5-8H2,(H,25,27)/b14-9+