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

Systemtic Name: 2-cyano-3-[1-(2-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(phenylmethyl)prop-2-enamide Openeye Name: N-benzyl-2-cyano-3-[1-(2-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enamide CAS Name: 2-cyano-3-[1-(2-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]-N-(phenylmethyl)-2-propenamide IUPAC Name: N-benzyl-2-cyano-3-[1-(2-fluorophenyl)-2,5-dimethylpyrrol-3-yl]prop-2-enamide Traditional Name: N-benzyl-2-cyano-3-[1-(2-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]acrylamide Formula: C23H20FN3O MolecularWeight: 373.422803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2F)C)C=C(C#N)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2F)C)C=C(C#N)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H20FN3O/c1-16-12-19(17(2)27(16)22-11-7-6-10-21(22)24)13-20(14-25)23(28)26-15-18-8-4-3-5-9-18/h3-13H,15H2,1-2H3,(H,26,28)