N-[[3,5-bis(bromanyl)-4-oxidanyl-phenyl]carbamothioyl]-4-fluoranyl-benzamide

Systemtic Name: N-[[3,5-bis(bromanyl)-4-oxidanyl-phenyl]carbamothioyl]-4-fluoranyl-benzamide Openeye Name: N-[(3,5-dibromo-4-hydroxy-phenyl)carbamothioyl]-4-fluoro-benzamide CAS Name: N-[(3,5-dibromo-4-hydroxyanilino)-sulfanylidenemethyl]-4-fluorobenzamide IUPAC Name: N-[(3,5-dibromo-4-hydroxyphenyl)carbamothioyl]-4-fluorobenzamide Traditional Name: N-[(3,5-dibromo-4-hydroxy-phenyl)thiocarbamoyl]-4-fluoro-benzamide Formula: C14H9Br2FN2O2S MolecularWeight: 448.104863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(=S)NC2=CC(=C(C(=C2)Br)O)Br)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(=S)NC2=CC(=C(C(=C2)Br)O)Br)F

InChI

InChI=1S/C14H9Br2FN2O2S/c15-10-5-9(6-11(16)12(10)20)18-14(22)19-13(21)7-1-3-8(17)4-2-7/h1-6,20H,(H2,18,19,21,22)