ethyl 4-[[4-(phenylsulfamoyl)phenyl]carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[[4-(phenylsulfamoyl)phenyl]carbamothioylamino]benzoate Openeye Name: ethyl 4-[[4-(phenylsulfamoyl)phenyl]carbamothioylamino]benzoate CAS Name: 4-[[[4-(phenylsulfamoyl)anilino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(phenylsulfamoyl)phenyl]carbamothioylamino]benzoate Traditional Name: 4-[[4-(phenylsulfamoyl)phenyl]thiocarbamoylamino]benzoic acid ethyl ester Formula: C22H21N3O4S2 MolecularWeight: 455.54984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H21N3O4S2/c1-2-29-21(26)16-8-10-17(11-9-16)23-22(30)24-18-12-14-20(15-13-18)31(27,28)25-19-6-4-3-5-7-19/h3-15,25H,2H2,1H3,(H2,23,24,30)