2-bromanyl-N-[[2-(2-butan-2-ylphenoxy)ethanoylamino]carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[[2-(2-butan-2-ylphenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 2-bromo-N-[[[2-(2-sec-butylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 2-bromo-N-[[[2-(2-butan-2-ylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[[[2-(2-butan-2-ylphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 2-bromo-N-[[[2-(2-sec-butylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C20H22BrN3O3S MolecularWeight: 464.37598

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCC(=O)NNC(=S)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CCC(C)C1=CC=CC=C1OCC(=O)NNC(=S)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C20H22BrN3O3S/c1-3-13(2)14-8-5-7-11-17(14)27-12-18(25)23-24-20(28)22-19(26)15-9-4-6-10-16(15)21/h4-11,13H,3,12H2,1-2H3,(H,23,25)(H2,22,24,26,28)