propan-2-yl 4-[[4-[(4-chlorophenyl)sulfamoyl]phenyl]carbamothioylamino]benzoate

Systemtic Name: propan-2-yl 4-[[4-[(4-chlorophenyl)sulfamoyl]phenyl]carbamothioylamino]benzoate Openeye Name: isopropyl 4-[[4-[(4-chlorophenyl)sulfamoyl]phenyl]carbamothioylamino]benzoate CAS Name: 4-[[[4-[(4-chlorophenyl)sulfamoyl]anilino]-sulfanylidenemethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[4-[(4-chlorophenyl)sulfamoyl]phenyl]carbamothioylamino]benzoate Traditional Name: 4-[[4-[(4-chlorophenyl)sulfamoyl]phenyl]thiocarbamoylamino]benzoic acid isopropyl ester Formula: C23H22ClN3O4S2 MolecularWeight: 504.02148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22ClN3O4S2/c1-15(2)31-22(28)16-3-7-18(8-4-16)25-23(32)26-19-11-13-21(14-12-19)33(29,30)27-20-9-5-17(24)6-10-20/h3-15,27H,1-2H3,(H2,25,26,32)