(E)-N-(4-acetamidophenyl)-2-cyano-3-[2,5-dimethyl-1-(2-methylpropyl)pyrrol-3-yl]prop-2-enamide

Systemtic Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-[2,5-dimethyl-1-(2-methylpropyl)pyrrol-3-yl]prop-2-enamide Openeye Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(1-isobutyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enamide CAS Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-[2,5-dimethyl-1-(2-methylpropyl)-3-pyrrolyl]-2-propenamide IUPAC Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-[2,5-dimethyl-1-(2-methylpropyl)pyrrol-3-yl]prop-2-enamide Traditional Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(1-isobutyl-2,5-dimethyl-pyrrol-3-yl)acrylamide Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC(C)C)C)C=C(C#N)C(=O)NC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC1=CC(=C(N1CC(C)C)C)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C22H26N4O2/c1-14(2)13-26-15(3)10-18(16(26)4)11-19(12-23)22(28)25-21-8-6-20(7-9-21)24-17(5)27/h6-11,14H,13H2,1-5H3,(H,24,27)(H,25,28)/b19-11+