4-bromanyl-N-[(3-chloranyl-5-nitro-2-oxidanyl-phenyl)carbamothioyl]benzamide

Systemtic Name: 4-bromanyl-N-[(3-chloranyl-5-nitro-2-oxidanyl-phenyl)carbamothioyl]benzamide Openeye Name: 4-bromo-N-[(3-chloro-2-hydroxy-5-nitro-phenyl)carbamothioyl]benzamide CAS Name: 4-bromo-N-[(3-chloro-2-hydroxy-5-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-bromo-N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]benzamide Traditional Name: 4-bromo-N-[(3-chloro-2-hydroxy-5-nitro-phenyl)thiocarbamoyl]benzamide Formula: C14H9BrClN3O4S MolecularWeight: 430.66096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(=S)NC2=CC(=CC(=C2O)Cl)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(=S)NC2=CC(=CC(=C2O)Cl)[N+](=O)[O-])Br

InChI

InChI=1S/C14H9BrClN3O4S/c15-8-3-1-7(2-4-8)13(21)18-14(24)17-11-6-9(19(22)23)5-10(16)12(11)20/h1-6,20H,(H2,17,18,21,24)