N-[[2-[2,4-bis(bromanyl)phenoxy]ethanoylamino]carbamothioyl]-2-fluoranyl-benzamide

Systemtic Name: N-[[2-[2,4-bis(bromanyl)phenoxy]ethanoylamino]carbamothioyl]-2-fluoranyl-benzamide Openeye Name: N-[[[2-(2,4-dibromophenoxy)acetyl]amino]carbamothioyl]-2-fluoro-benzamide CAS Name: N-[[[2-(2,4-dibromophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-fluorobenzamide IUPAC Name: N-[[[2-(2,4-dibromophenoxy)acetyl]amino]carbamothioyl]-2-fluorobenzamide Traditional Name: N-[[[2-(2,4-dibromophenoxy)acetyl]amino]thiocarbamoyl]-2-fluoro-benzamide Formula: C16H12Br2FN3O3S MolecularWeight: 505.156183

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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)Br)Br)F

Isomeric SMILES

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

InChI

InChI=1S/C16H12Br2FN3O3S/c17-9-5-6-13(11(18)7-9)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)