N-[[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]carbamothioyl]-2-(3-methylphenoxy)ethanamide

Systemtic Name: N-[[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]carbamothioyl]-2-(3-methylphenoxy)ethanamide Openeye Name: N-[[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]carbamothioyl]-2-(3-methylphenoxy)acetamide CAS Name: N-[[[2-(2-bromo-4-ethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-(3-methylphenoxy)acetamide IUPAC Name: N-[[[2-(2-bromo-4-ethylphenoxy)acetyl]amino]carbamothioyl]-2-(3-methylphenoxy)acetamide Traditional Name: N-[[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]thiocarbamoyl]-2-(3-methylphenoxy)acetamide Formula: C20H22BrN3O4S MolecularWeight: 480.37538

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)COC2=CC=CC(=C2)C)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)COC2=CC=CC(=C2)C)Br

InChI

InChI=1S/C20H22BrN3O4S/c1-3-14-7-8-17(16(21)10-14)28-12-19(26)23-24-20(29)22-18(25)11-27-15-6-4-5-13(2)9-15/h4-10H,3,11-12H2,1-2H3,(H,23,26)(H2,22,24,25,29)