2-(4-bromanyl-2-methyl-phenoxy)-N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanyl-2-methyl-phenoxy)-N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-2-methyl-phenoxy)-N-[[4-(thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]acetamide CAS Name: 2-(4-bromo-2-methylphenoxy)-N-[sulfanylidene-[4-(2-thiazolylsulfamoyl)anilino]methyl]acetamide IUPAC Name: 2-(4-bromo-2-methylphenoxy)-N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]acetamide Traditional Name: 2-(4-bromo-2-methyl-phenoxy)-N-[[4-(thiazol-2-ylsulfamoyl)phenyl]thiocarbamoyl]acetamide Formula: C19H17BrN4O4S3 MolecularWeight: 541.46168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCC(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCC(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

InChI

InChI=1S/C19H17BrN4O4S3/c1-12-10-13(20)2-7-16(12)28-11-17(25)23-18(29)22-14-3-5-15(6-4-14)31(26,27)24-19-21-8-9-30-19/h2-10H,11H2,1H3,(H,21,24)(H2,22,23,25,29)