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

Systemtic Name: 4-bromanyl-N-[(3-nitrophenyl)carbamothioyl]benzamide Openeye Name: 4-bromo-N-[(3-nitrophenyl)carbamothioyl]benzamide CAS Name: 4-bromo-N-[(3-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-bromo-N-[(3-nitrophenyl)carbamothioyl]benzamide Traditional Name: 4-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)[N+](=O)[O-])NC(=S)NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

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

InChI

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