[2-[[4-(dimethylsulfamoyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoate

Systemtic Name: [2-[[4-(dimethylsulfamoyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoate Openeye Name: [2-[4-(dimethylsulfamoyl)anilino]-2-oxo-ethyl] 3-(3-oxo-4H-quinoxalin-2-yl)propanoate CAS Name: 3-(3-oxo-4H-quinoxalin-2-yl)propanoic acid [2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl] 3-(3-oxo-4H-quinoxalin-2-yl)propanoate Traditional Name: 3-(3-keto-4H-quinoxalin-2-yl)propionic acid [2-[4-(dimethylsulfamoyl)anilino]-2-keto-ethyl] ester Formula: C21H22N4O6S MolecularWeight: 458.48758

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CCC2=NC3=CC=CC=C3NC2=O

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CCC2=NC3=CC=CC=C3NC2=O

InChI

InChI=1S/C21H22N4O6S/c1-25(2)32(29,30)15-9-7-14(8-10-15)22-19(26)13-31-20(27)12-11-18-21(28)24-17-6-4-3-5-16(17)23-18/h3-10H,11-13H2,1-2H3,(H,22,26)(H,24,28)