N-[[2-(2-bromanyl-4-chloranyl-phenoxy)ethanoylamino]carbamothioyl]-2-iodanyl-benzamide

Systemtic Name: N-[[2-(2-bromanyl-4-chloranyl-phenoxy)ethanoylamino]carbamothioyl]-2-iodanyl-benzamide Openeye Name: N-[[[2-(2-bromo-4-chloro-phenoxy)acetyl]amino]carbamothioyl]-2-iodo-benzamide CAS Name: N-[[[2-(2-bromo-4-chlorophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-iodobenzamide IUPAC Name: N-[[[2-(2-bromo-4-chlorophenoxy)acetyl]amino]carbamothioyl]-2-iodobenzamide Traditional Name: N-[[[2-(2-bromo-4-chloro-phenoxy)acetyl]amino]thiocarbamoyl]-2-iodo-benzamide Formula: C16H12BrClIN3O3S MolecularWeight: 568.61125

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=S)NNC(=O)COC2=C(C=C(C=C2)Cl)Br)I

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=S)NNC(=O)COC2=C(C=C(C=C2)Cl)Br)I

InChI

InChI=1S/C16H12BrClIN3O3S/c17-11-7-9(18)5-6-13(11)25-8-14(23)21-22-16(26)20-15(24)10-3-1-2-4-12(10)19/h1-7H,8H2,(H,21,23)(H2,20,22,24,26)