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

Systemtic Name: propan-2-yl 4-[[4-[(2-methylphenyl)sulfamoyl]phenyl]carbamothioylamino]benzoate Openeye Name: isopropyl 4-[[4-(o-tolylsulfamoyl)phenyl]carbamothioylamino]benzoate CAS Name: 4-[[[4-[(2-methylphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[4-[(2-methylphenyl)sulfamoyl]phenyl]carbamothioylamino]benzoate Traditional Name: 4-[[4-(o-tolylsulfamoyl)phenyl]thiocarbamoylamino]benzoic acid isopropyl ester Formula: C24H25N3O4S2 MolecularWeight: 483.603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)C(=O)OC(C)C

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)C(=O)OC(C)C

InChI

InChI=1S/C24H25N3O4S2/c1-16(2)31-23(28)18-8-10-19(11-9-18)25-24(32)26-20-12-14-21(15-13-20)33(29,30)27-22-7-5-4-6-17(22)3/h4-16,27H,1-3H3,(H2,25,26,32)