[2-[1-(furan-2-yl)ethylamino]-2-oxidanylidene-ethyl] 4-(2-cyanoethylsulfamoyl)benzoate

Systemtic Name: [2-[1-(furan-2-yl)ethylamino]-2-oxidanylidene-ethyl] 4-(2-cyanoethylsulfamoyl)benzoate Openeye Name: [2-[1-(2-furyl)ethylamino]-2-oxo-ethyl] 4-(2-cyanoethylsulfamoyl)benzoate CAS Name: 4-(2-cyanoethylsulfamoyl)benzoic acid [2-[1-(2-furanyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(furan-2-yl)ethylamino]-2-oxoethyl] 4-(2-cyanoethylsulfamoyl)benzoate Traditional Name: 4-(2-cyanoethylsulfamoyl)benzoic acid [2-[1-(2-furyl)ethylamino]-2-keto-ethyl] ester Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CO1)NC(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N

Isomeric SMILES

CC(C1=CC=CO1)NC(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCC#N

InChI

InChI=1S/C18H19N3O6S/c1-13(16-4-2-11-26-16)21-17(22)12-27-18(23)14-5-7-15(8-6-14)28(24,25)20-10-3-9-19/h2,4-8,11,13,20H,3,10,12H2,1H3,(H,21,22)