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

Systemtic Name: 2-(2-bromanyl-4-ethyl-phenoxy)-N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]ethanamide Openeye Name: 2-(2-bromo-4-ethyl-phenoxy)-N-[[4-(thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]acetamide CAS Name: 2-(2-bromo-4-ethylphenoxy)-N-[sulfanylidene-[4-(2-thiazolylsulfamoyl)anilino]methyl]acetamide IUPAC Name: 2-(2-bromo-4-ethylphenoxy)-N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]acetamide Traditional Name: 2-(2-bromo-4-ethyl-phenoxy)-N-[[4-(thiazol-2-ylsulfamoyl)phenyl]thiocarbamoyl]acetamide Formula: C20H19BrN4O4S3 MolecularWeight: 555.48826

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)Br

InChI

InChI=1S/C20H19BrN4O4S3/c1-2-13-3-8-17(16(21)11-13)29-12-18(26)24-19(30)23-14-4-6-15(7-5-14)32(27,28)25-20-22-9-10-31-20/h3-11H,2,12H2,1H3,(H,22,25)(H2,23,24,26,30)