2-bromanyl-N-[[3-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[[3-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: 2-bromo-N-[[3-[(3-chloro-4-fluoro-phenyl)carbamoyl]phenyl]carbamothioyl]benzamide CAS Name: 2-bromo-N-[[3-[(3-chloro-4-fluoroanilino)-oxomethyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[[3-[(3-chloro-4-fluorophenyl)carbamoyl]phenyl]carbamothioyl]benzamide Traditional Name: 2-bromo-N-[[3-[(3-chloro-4-fluoro-phenyl)carbamoyl]phenyl]thiocarbamoyl]benzamide Formula: C21H14BrClFN3O2S MolecularWeight: 506.775163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC(=C(C=C3)F)Cl)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC(=C(C=C3)F)Cl)Br

InChI

InChI=1S/C21H14BrClFN3O2S/c22-16-7-2-1-6-15(16)20(29)27-21(30)26-13-5-3-4-12(10-13)19(28)25-14-8-9-18(24)17(23)11-14/h1-11H,(H,25,28)(H2,26,27,29,30)