3-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-(2-fluorophenyl)prop-2-enamide

Systemtic Name: 3-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-(2-fluorophenyl)prop-2-enamide Openeye Name: 3-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-(2-fluorophenyl)prop-2-enamide CAS Name: 3-[1-(4-bromophenyl)-2,5-dimethyl-3-pyrrolyl]-2-cyano-N-(2-fluorophenyl)-2-propenamide IUPAC Name: 3-[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]-2-cyano-N-(2-fluorophenyl)prop-2-enamide Traditional Name: 3-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-(2-fluorophenyl)acrylamide Formula: C22H17BrFN3O MolecularWeight: 438.292283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C=C(C#N)C(=O)NC3=CC=CC=C3F

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C=C(C#N)C(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C22H17BrFN3O/c1-14-11-16(15(2)27(14)19-9-7-18(23)8-10-19)12-17(13-25)22(28)26-21-6-4-3-5-20(21)24/h3-12H,1-2H3,(H,26,28)