N-[[3,5-bis(bromanyl)-4-oxidanyl-phenyl]carbamothioyl]-2-(4-chlorophenyl)ethanamide

Systemtic Name: N-[[3,5-bis(bromanyl)-4-oxidanyl-phenyl]carbamothioyl]-2-(4-chlorophenyl)ethanamide Openeye Name: 2-(4-chlorophenyl)-N-[(3,5-dibromo-4-hydroxy-phenyl)carbamothioyl]acetamide CAS Name: 2-(4-chlorophenyl)-N-[(3,5-dibromo-4-hydroxyanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenyl)-N-[(3,5-dibromo-4-hydroxyphenyl)carbamothioyl]acetamide Traditional Name: 2-(4-chlorophenyl)-N-[(3,5-dibromo-4-hydroxy-phenyl)thiocarbamoyl]acetamide Formula: C15H11Br2ClN2O2S MolecularWeight: 478.58604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)NC(=S)NC2=CC(=C(C(=C2)Br)O)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1CC(=O)NC(=S)NC2=CC(=C(C(=C2)Br)O)Br)Cl

InChI

InChI=1S/C15H11Br2ClN2O2S/c16-11-6-10(7-12(17)14(11)22)19-15(23)20-13(21)5-8-1-3-9(18)4-2-8/h1-4,6-7,22H,5H2,(H2,19,20,21,23)