N-[[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoylamino]carbamothioyl]-2-(4-chlorophenyl)ethanamide

Systemtic Name: N-[[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoylamino]carbamothioyl]-2-(4-chlorophenyl)ethanamide Openeye Name: N-[[[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]amino]carbamothioyl]-2-(4-chlorophenyl)acetamide CAS Name: N-[[[2-(2-bromo-4-tert-butylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-(4-chlorophenyl)acetamide IUPAC Name: N-[[[2-(2-bromo-4-tert-butylphenoxy)acetyl]amino]carbamothioyl]-2-(4-chlorophenyl)acetamide Traditional Name: N-[[[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]amino]thiocarbamoyl]-2-(4-chlorophenyl)acetamide Formula: C21H23BrClN3O3S MolecularWeight: 512.84762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)CC2=CC=C(C=C2)Cl)Br

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)CC2=CC=C(C=C2)Cl)Br

InChI

InChI=1S/C21H23BrClN3O3S/c1-21(2,3)14-6-9-17(16(22)11-14)29-12-19(28)25-26-20(30)24-18(27)10-13-4-7-15(23)8-5-13/h4-9,11H,10,12H2,1-3H3,(H,25,28)(H2,24,26,27,30)