5-bromanyl-N-[[2-(4-nitrophenoxy)ethanoylamino]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[[2-(4-nitrophenoxy)ethanoylamino]carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[[[2-(4-nitrophenoxy)acetyl]amino]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[[2-(4-nitrophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[[2-(4-nitrophenoxy)acetyl]amino]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[[[2-(4-nitrophenoxy)acetyl]amino]thiocarbamoyl]-2-furamide Formula: C14H11BrN4O6S MolecularWeight: 443.22934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OCC(=O)NNC(=S)NC(=O)C2=CC=C(O2)Br

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OCC(=O)NNC(=S)NC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C14H11BrN4O6S/c15-11-6-5-10(25-11)13(21)16-14(26)18-17-12(20)7-24-9-3-1-8(2-4-9)19(22)23/h1-6H,7H2,(H,17,20)(H2,16,18,21,26)