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

Systemtic Name: N-[[3,5-bis(bromanyl)-4-oxidanyl-phenyl]carbamothioyl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[(3,5-dibromo-4-hydroxy-phenyl)carbamothioyl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[(3,5-dibromo-4-hydroxyanilino)-sulfanylidenemethyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[(3,5-dibromo-4-hydroxyphenyl)carbamothioyl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[(3,5-dibromo-4-hydroxy-phenyl)thiocarbamoyl]-2-(4-nitrophenoxy)acetamide Formula: C15H11Br2N3O5S MolecularWeight: 505.13794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OCC(=O)NC(=S)NC2=CC(=C(C(=C2)Br)O)Br

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OCC(=O)NC(=S)NC2=CC(=C(C(=C2)Br)O)Br

InChI

InChI=1S/C15H11Br2N3O5S/c16-11-5-8(6-12(17)14(11)22)18-15(26)19-13(21)7-25-10-3-1-9(2-4-10)20(23)24/h1-6,22H,7H2,(H2,18,19,21,26)