2-(4-bromanylphenoxy)-N-[(2-naphthalen-2-yloxyethanoylamino)carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[(2-naphthalen-2-yloxyethanoylamino)carbamothioyl]ethanamide Openeye Name: 2-(4-bromophenoxy)-N-[[[2-(2-naphthyloxy)acetyl]amino]carbamothioyl]acetamide CAS Name: 2-(4-bromophenoxy)-N-[[[2-(2-naphthalenyloxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-[[(2-naphthalen-2-yloxyacetyl)amino]carbamothioyl]acetamide Traditional Name: 2-(4-bromophenoxy)-N-[[[2-(2-naphthoxy)acetyl]amino]thiocarbamoyl]acetamide Formula: C21H18BrN3O4S MolecularWeight: 488.35432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)OCC(=O)NNC(=S)NC(=O)COC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)OCC(=O)NNC(=S)NC(=O)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H18BrN3O4S/c22-16-6-9-17(10-7-16)28-12-19(26)23-21(30)25-24-20(27)13-29-18-8-5-14-3-1-2-4-15(14)11-18/h1-11H,12-13H2,(H,24,27)(H2,23,25,26,30)