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

Systemtic Name: N-[(3-chloranyl-5-nitro-2-oxidanyl-phenyl)carbamothioyl]-4-fluoranyl-benzamide Openeye Name: N-[(3-chloro-2-hydroxy-5-nitro-phenyl)carbamothioyl]-4-fluoro-benzamide CAS Name: N-[(3-chloro-2-hydroxy-5-nitroanilino)-sulfanylidenemethyl]-4-fluorobenzamide IUPAC Name: N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]-4-fluorobenzamide Traditional Name: N-[(3-chloro-2-hydroxy-5-nitro-phenyl)thiocarbamoyl]-4-fluoro-benzamide Formula: C14H9ClFN3O4S MolecularWeight: 369.755363

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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-])F

Isomeric SMILES

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

InChI

InChI=1S/C14H9ClFN3O4S/c15-10-5-9(19(22)23)6-11(12(10)20)17-14(24)18-13(21)7-1-3-8(16)4-2-7/h1-6,20H,(H2,17,18,21,24)