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

Systemtic Name: 4-chloranyl-N-[(5-nitro-2-oxidanyl-phenyl)carbamothioyl]benzamide Openeye Name: 4-chloro-N-[(2-hydroxy-5-nitro-phenyl)carbamothioyl]benzamide CAS Name: 4-chloro-N-[(2-hydroxy-5-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-N-[(2-hydroxy-5-nitrophenyl)carbamothioyl]benzamide Traditional Name: 4-chloro-N-[(2-hydroxy-5-nitro-phenyl)thiocarbamoyl]benzamide Formula: C14H10ClN3O4S MolecularWeight: 351.7649

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])O)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])O)Cl

InChI

InChI=1S/C14H10ClN3O4S/c15-9-3-1-8(2-4-9)13(20)17-14(23)16-11-7-10(18(21)22)5-6-12(11)19/h1-7,19H,(H2,16,17,20,23)