4-bromanyl-N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 4-bromanyl-N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]benzamide Openeye Name: 4-bromo-N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]benzamide CAS Name: 4-bromo-N-[[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-bromo-N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamothioyl]benzamide Traditional Name: 4-bromo-N-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]thiocarbamoyl]benzamide Formula: C20H18BrN5O3S2 MolecularWeight: 520.42262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C20H18BrN5O3S2/c1-12-11-13(2)23-19(22-12)26-31(28,29)17-9-7-16(8-10-17)24-20(30)25-18(27)14-3-5-15(21)6-4-14/h3-11H,1-2H3,(H,22,23,26)(H2,24,25,27,30)