5-bromanyl-N-[[4-[(2,4-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[[4-[(2,4-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[[4-[(2,4-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[4-[(2,4-dimethylphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[4-[(2,4-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[[4-[(2,4-dimethylphenyl)sulfamoyl]phenyl]thiocarbamoyl]-2-furamide Formula: C20H18BrN3O4S2 MolecularWeight: 508.40862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(O3)Br)C

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(O3)Br)C

InChI

InChI=1S/C20H18BrN3O4S2/c1-12-3-8-16(13(2)11-12)24-30(26,27)15-6-4-14(5-7-15)22-20(29)23-19(25)17-9-10-18(21)28-17/h3-11,24H,1-2H3,(H2,22,23,25,29)