(E)-2-cyano-3-[3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-pyrazol-4-yl]-N-(3-imidazol-1-ylpropyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-pyrazol-4-yl]-N-(3-imidazol-1-ylpropyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-pyrazol-4-yl]-N-(3-imidazol-1-ylpropyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-4-pyrazolyl]-N-[3-(1-imidazolyl)propyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-[3-[3-(dimethylsulfamoyl)phenyl]-1-phenylpyrazol-4-yl]-N-(3-imidazol-1-ylpropyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-pyrazol-4-yl]-N-(3-imidazol-1-ylpropyl)acrylamide Formula: C27H27N7O3S MolecularWeight: 529.61338

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)C2=NN(C=C2C=C(C#N)C(=O)NCCCN3C=CN=C3)C4=CC=CC=C4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NCCCN3C=CN=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H27N7O3S/c1-32(2)38(36,37)25-11-6-8-21(17-25)26-23(19-34(31-26)24-9-4-3-5-10-24)16-22(18-28)27(35)30-12-7-14-33-15-13-29-20-33/h3-6,8-11,13,15-17,19-20H,7,12,14H2,1-2H3,(H,30,35)/b22-16+