5-bromanyl-N-[[2-(4-ethylphenoxy)ethanoylamino]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[[2-(4-ethylphenoxy)ethanoylamino]carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[[[2-(4-ethylphenoxy)acetyl]amino]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[[2-(4-ethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[[2-(4-ethylphenoxy)acetyl]amino]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[[[2-(4-ethylphenoxy)acetyl]amino]thiocarbamoyl]-2-furamide Formula: C16H16BrN3O4S MolecularWeight: 426.28494

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=C(O2)Br

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C16H16BrN3O4S/c1-2-10-3-5-11(6-4-10)23-9-14(21)19-20-16(25)18-15(22)12-7-8-13(17)24-12/h3-8H,2,9H2,1H3,(H,19,21)(H2,18,20,22,25)