[2-oxidanylidene-2-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethyl] 3-(4-sulfamoylphenyl)propanoate

Systemtic Name: [2-oxidanylidene-2-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethyl] 3-(4-sulfamoylphenyl)propanoate Openeye Name: [2-oxo-2-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethyl] 3-(4-sulfamoylphenyl)propanoate CAS Name: 3-(4-sulfamoylphenyl)propanoic acid [2-oxo-2-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethyl] 3-(4-sulfamoylphenyl)propanoate Traditional Name: 3-(4-sulfamoylphenyl)propionic acid [2-keto-2-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethyl] ester Formula: C25H24N2O5S2 MolecularWeight: 496.59846

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C2=CC=CC=C2S1)C(=O)COC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=CC=C4

Isomeric SMILES

C1C(N(C2=CC=CC=C2S1)C(=O)COC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C25H24N2O5S2/c26-34(30,31)20-13-10-18(11-14-20)12-15-25(29)32-16-24(28)27-21-8-4-5-9-23(21)33-17-22(27)19-6-2-1-3-7-19/h1-11,13-14,22H,12,15-17H2,(H2,26,30,31)