N-[[2-(4-bromanyl-3-methyl-phenoxy)ethanoylamino]carbamothioyl]-2-naphthalen-2-yloxy-ethanamide

Systemtic Name: N-[[2-(4-bromanyl-3-methyl-phenoxy)ethanoylamino]carbamothioyl]-2-naphthalen-2-yloxy-ethanamide Openeye Name: N-[[[2-(4-bromo-3-methyl-phenoxy)acetyl]amino]carbamothioyl]-2-(2-naphthyloxy)acetamide CAS Name: N-[[[2-(4-bromo-3-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-(2-naphthalenyloxy)acetamide IUPAC Name: N-[[[2-(4-bromo-3-methylphenoxy)acetyl]amino]carbamothioyl]-2-naphthalen-2-yloxyacetamide Traditional Name: N-[[[2-(4-bromo-3-methyl-phenoxy)acetyl]amino]thiocarbamoyl]-2-(2-naphthoxy)acetamide Formula: C22H20BrN3O4S MolecularWeight: 502.3809

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NNC(=S)NC(=O)COC2=CC3=CC=CC=C3C=C2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NNC(=S)NC(=O)COC2=CC3=CC=CC=C3C=C2)Br

InChI

InChI=1S/C22H20BrN3O4S/c1-14-10-17(8-9-19(14)23)30-13-21(28)25-26-22(31)24-20(27)12-29-18-7-6-15-4-2-3-5-16(15)11-18/h2-11H,12-13H2,1H3,(H,25,28)(H2,24,26,27,31)