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

Systemtic Name: 4-bromanyl-2-methyl-N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]pyrazole-3-carboxamide Openeye Name: 4-bromo-2-methyl-N-[[4-(thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]pyrazole-3-carboxamide CAS Name: 4-bromo-2-methyl-N-[sulfanylidene-[4-(2-thiazolylsulfamoyl)anilino]methyl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-2-methyl-N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]pyrazole-3-carboxamide Traditional Name: 4-bromo-2-methyl-N-[[4-(thiazol-2-ylsulfamoyl)phenyl]thiocarbamoyl]pyrazole-3-carboxamide Formula: C15H13BrN6O3S3 MolecularWeight: 501.40112

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

Isomeric SMILES

CN1C(=C(C=N1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

InChI

InChI=1S/C15H13BrN6O3S3/c1-22-12(11(16)8-18-22)13(23)20-14(26)19-9-2-4-10(5-3-9)28(24,25)21-15-17-6-7-27-15/h2-8H,1H3,(H,17,21)(H2,19,20,23,26)