N-[[2-(4-bromanyl-3-methyl-phenoxy)ethanoylamino]carbamothioyl]-2-naphthalen-1-yloxy-ethanamide

Systemtic Name: N-[[2-(4-bromanyl-3-methyl-phenoxy)ethanoylamino]carbamothioyl]-2-naphthalen-1-yloxy-ethanamide Openeye Name: N-[[[2-(4-bromo-3-methyl-phenoxy)acetyl]amino]carbamothioyl]-2-(1-naphthyloxy)acetamide CAS Name: N-[[[2-(4-bromo-3-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-(1-naphthalenyloxy)acetamide IUPAC Name: N-[[[2-(4-bromo-3-methylphenoxy)acetyl]amino]carbamothioyl]-2-naphthalen-1-yloxyacetamide Traditional Name: N-[[[2-(4-bromo-3-methyl-phenoxy)acetyl]amino]thiocarbamoyl]-2-(1-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=CC=CC3=CC=CC=C32)Br

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NNC(=S)NC(=O)COC2=CC=CC3=CC=CC=C32)Br

InChI

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