(E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-[3-(dimethylsulfamoyl)phenyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-[3-(dimethylsulfamoyl)phenyl]prop-2-enamide Openeye Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-[3-(dimethylsulfamoyl)phenyl]prop-2-enamide CAS Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-3-pyrrolyl)-N-[3-(dimethylsulfamoyl)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-(2,5-dimethyl-1-propylpyrrol-3-yl)-N-[3-(dimethylsulfamoyl)phenyl]prop-2-enamide Traditional Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-[3-(dimethylsulfamoyl)phenyl]acrylamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C=C(C#N)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N(C)C)C

Isomeric SMILES

CCCN1C(=CC(=C1C)/C=C(\C#N)/C(=O)NC2=CC(=CC=C2)S(=O)(=O)N(C)C)C

InChI

InChI=1S/C21H26N4O3S/c1-6-10-25-15(2)11-17(16(25)3)12-18(14-22)21(26)23-19-8-7-9-20(13-19)29(27,28)24(4)5/h7-9,11-13H,6,10H2,1-5H3,(H,23,26)/b18-12+