3-bromanyl-N-[(3-nitrophenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-N-[(3-nitrophenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-N-[(3-nitrophenyl)carbamothioyl]benzamide CAS Name: 3-bromo-N-[(3-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-N-[(3-nitrophenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-N-[(3-nitrophenyl)thiocarbamoyl]benzamide Formula: C14H10BrN3O3S MolecularWeight: 380.2165

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10BrN3O3S/c15-10-4-1-3-9(7-10)13(19)17-14(22)16-11-5-2-6-12(8-11)18(20)21/h1-8H,(H2,16,17,19,22)