N-[[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]carbamothioyl]-2-(2,5-dimethylphenoxy)ethanamide

Systemtic Name: N-[[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]carbamothioyl]-2-(2,5-dimethylphenoxy)ethanamide Openeye Name: N-[[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]carbamothioyl]-2-(2,5-dimethylphenoxy)acetamide CAS Name: N-[[[2-(2-bromo-4-ethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-(2,5-dimethylphenoxy)acetamide IUPAC Name: N-[[[2-(2-bromo-4-ethylphenoxy)acetyl]amino]carbamothioyl]-2-(2,5-dimethylphenoxy)acetamide Traditional Name: N-[[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]thiocarbamoyl]-2-(2,5-dimethylphenoxy)acetamide Formula: C21H24BrN3O4S MolecularWeight: 494.40196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24BrN3O4S/c1-4-15-7-8-17(16(22)10-15)28-12-20(27)24-25-21(30)23-19(26)11-29-18-9-13(2)5-6-14(18)3/h5-10H,4,11-12H2,1-3H3,(H,24,27)(H2,23,25,26,30)