(1-cyanoindolizin-2-yl)methyl 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate CAS Name: 5-(dimethylsulfamoyl)-2-(1-pyrrolidinyl)benzoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 5-(dimethylsulfamoyl)-2-pyrrolidin-1-ylbenzoate Traditional Name: 5-(dimethylsulfamoyl)-2-pyrrolidino-benzoic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)OCC3=CN4C=CC=CC4=C3C#N

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)OCC3=CN4C=CC=CC4=C3C#N

InChI

InChI=1S/C23H24N4O4S/c1-25(2)32(29,30)18-8-9-22(26-10-5-6-11-26)19(13-18)23(28)31-16-17-15-27-12-4-3-7-21(27)20(17)14-24/h3-4,7-9,12-13,15H,5-6,10-11,16H2,1-2H3