N-[[2-(4-butan-2-ylphenoxy)ethanoylamino]carbamothioyl]-2-fluoranyl-benzamide

Systemtic Name: N-[[2-(4-butan-2-ylphenoxy)ethanoylamino]carbamothioyl]-2-fluoranyl-benzamide Openeye Name: 2-fluoro-N-[[[2-(4-sec-butylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: N-[[[2-(4-butan-2-ylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-fluorobenzamide IUPAC Name: N-[[[2-(4-butan-2-ylphenoxy)acetyl]amino]carbamothioyl]-2-fluorobenzamide Traditional Name: 2-fluoro-N-[[[2-(4-sec-butylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C20H22FN3O3S MolecularWeight: 403.470383

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=CC=C2F

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=CC=C2F

InChI

InChI=1S/C20H22FN3O3S/c1-3-13(2)14-8-10-15(11-9-14)27-12-18(25)23-24-20(28)22-19(26)16-6-4-5-7-17(16)21/h4-11,13H,3,12H2,1-2H3,(H,23,25)(H2,22,24,26,28)