(1-cyanoindolizin-2-yl)methyl 5-(diethylsulfamoyl)-2-morpholin-4-yl-benzoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 5-(diethylsulfamoyl)-2-morpholin-4-yl-benzoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 5-(diethylsulfamoyl)-2-morpholino-benzoate CAS Name: 5-(diethylsulfamoyl)-2-(4-morpholinyl)benzoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 5-(diethylsulfamoyl)-2-morpholin-4-ylbenzoate Traditional Name: 5-(diethylsulfamoyl)-2-morpholino-benzoic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C25H28N4O5S MolecularWeight: 496.57862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)C(=O)OCC3=CN4C=CC=CC4=C3C#N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)C(=O)OCC3=CN4C=CC=CC4=C3C#N

InChI

InChI=1S/C25H28N4O5S/c1-3-29(4-2)35(31,32)20-8-9-24(27-11-13-33-14-12-27)21(15-20)25(30)34-18-19-17-28-10-6-5-7-23(28)22(19)16-26/h5-10,15,17H,3-4,11-14,18H2,1-2H3