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

Systemtic Name: 2-bromanyl-N-[(3-nitrophenyl)carbamothioyl]benzamide Openeye Name: 2-bromo-N-[(3-nitrophenyl)carbamothioyl]benzamide CAS Name: 2-bromo-N-[(3-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[(3-nitrophenyl)carbamothioyl]benzamide Traditional Name: 2-bromo-N-[(3-nitrophenyl)thiocarbamoyl]benzamide Formula: C14H10BrN3O3S MolecularWeight: 380.2165

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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