N-[[2-(2-bromanyl-4-chloranyl-phenoxy)ethanoylamino]carbamothioyl]-2-naphthalen-1-yl-ethanamide

Systemtic Name: N-[[2-(2-bromanyl-4-chloranyl-phenoxy)ethanoylamino]carbamothioyl]-2-naphthalen-1-yl-ethanamide Openeye Name: N-[[[2-(2-bromo-4-chloro-phenoxy)acetyl]amino]carbamothioyl]-2-(1-naphthyl)acetamide CAS Name: N-[[[2-(2-bromo-4-chlorophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-(1-naphthalenyl)acetamide IUPAC Name: N-[[[2-(2-bromo-4-chlorophenoxy)acetyl]amino]carbamothioyl]-2-naphthalen-1-ylacetamide Traditional Name: N-[[[2-(2-bromo-4-chloro-phenoxy)acetyl]amino]thiocarbamoyl]-2-(1-naphthyl)acetamide Formula: C21H17BrClN3O3S MolecularWeight: 506.79998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC(=O)NC(=S)NNC(=O)COC3=C(C=C(C=C3)Cl)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC(=O)NC(=S)NNC(=O)COC3=C(C=C(C=C3)Cl)Br

InChI

InChI=1S/C21H17BrClN3O3S/c22-17-11-15(23)8-9-18(17)29-12-20(28)25-26-21(30)24-19(27)10-14-6-3-5-13-4-1-2-7-16(13)14/h1-9,11H,10,12H2,(H,25,28)(H2,24,26,27,30)