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

Systemtic Name: 2-cyano-3-[1-(4-ethanoylphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(phenylmethyl)prop-2-enamide Openeye Name: 3-[1-(4-acetylphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-benzyl-2-cyano-prop-2-enamide CAS Name: 3-[1-(4-acetylphenyl)-2,5-dimethyl-3-pyrrolyl]-2-cyano-N-(phenylmethyl)-2-propenamide IUPAC Name: 3-[1-(4-acetylphenyl)-2,5-dimethylpyrrol-3-yl]-N-benzyl-2-cyanoprop-2-enamide Traditional Name: 3-[1-(4-acetylphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-benzyl-2-cyano-acrylamide Formula: C25H23N3O2 MolecularWeight: 397.46902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)C)C)C=C(C#N)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)C)C)C=C(C#N)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C25H23N3O2/c1-17-13-22(18(2)28(17)24-11-9-21(10-12-24)19(3)29)14-23(15-26)25(30)27-16-20-7-5-4-6-8-20/h4-14H,16H2,1-3H3,(H,27,30)