(5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(2-cyanoethylsulfamoyl)benzoate

Systemtic Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(2-cyanoethylsulfamoyl)benzoate Openeye Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(2-cyanoethylsulfamoyl)benzoate CAS Name: 3-(2-cyanoethylsulfamoyl)benzoic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester IUPAC Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(2-cyanoethylsulfamoyl)benzoate Traditional Name: 3-(2-cyanoethylsulfamoyl)benzoic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester Formula: C19H16N4O5S MolecularWeight: 412.41914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(O2)COC(=O)C3=CC(=CC=C3)S(=O)(=O)NCCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(O2)COC(=O)C3=CC(=CC=C3)S(=O)(=O)NCCC#N

InChI

InChI=1S/C19H16N4O5S/c20-10-5-11-21-29(25,26)16-9-4-8-15(12-16)19(24)27-13-17-22-23-18(28-17)14-6-2-1-3-7-14/h1-4,6-9,12,21H,5,11,13H2