2-(4-bromanyl-2-chloranyl-phenoxy)-N-[(5-nitro-2-oxidanyl-phenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanyl-2-chloranyl-phenoxy)-N-[(5-nitro-2-oxidanyl-phenyl)carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-2-chloro-phenoxy)-N-[(2-hydroxy-5-nitro-phenyl)carbamothioyl]acetamide CAS Name: 2-(4-bromo-2-chlorophenoxy)-N-[(2-hydroxy-5-nitroanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromo-2-chlorophenoxy)-N-[(2-hydroxy-5-nitrophenyl)carbamothioyl]acetamide Traditional Name: 2-(4-bromo-2-chloro-phenoxy)-N-[(2-hydroxy-5-nitro-phenyl)thiocarbamoyl]acetamide Formula: C15H11BrClN3O5S MolecularWeight: 460.68694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])NC(=S)NC(=O)COC2=C(C=C(C=C2)Br)Cl)O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])NC(=S)NC(=O)COC2=C(C=C(C=C2)Br)Cl)O

InChI

InChI=1S/C15H11BrClN3O5S/c16-8-1-4-13(10(17)5-8)25-7-14(22)19-15(26)18-11-6-9(20(23)24)2-3-12(11)21/h1-6,21H,7H2,(H2,18,19,22,26)