N-[[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]carbamothioyl]-2-(2-ethoxyethoxy)benzamide

Systemtic Name: N-[[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]carbamothioyl]-2-(2-ethoxyethoxy)benzamide Openeye Name: N-[[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]carbamothioyl]-2-(2-ethoxyethoxy)benzamide CAS Name: N-[[[2-(2-bromo-4-ethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-(2-ethoxyethoxy)benzamide IUPAC Name: N-[[[2-(2-bromo-4-ethylphenoxy)acetyl]amino]carbamothioyl]-2-(2-ethoxyethoxy)benzamide Traditional Name: N-[[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]thiocarbamoyl]-2-(2-ethoxyethoxy)benzamide Formula: C22H26BrN3O5S MolecularWeight: 524.42794

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=CC=C2OCCOCC)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=CC=C2OCCOCC)Br

InChI

InChI=1S/C22H26BrN3O5S/c1-3-15-9-10-19(17(23)13-15)31-14-20(27)25-26-22(32)24-21(28)16-7-5-6-8-18(16)30-12-11-29-4-2/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,25,27)(H2,24,26,28,32)