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

Systemtic Name: 5-bromanyl-N-[[2-(4-propan-2-ylphenoxy)ethanoylamino]carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[[[2-(4-isopropylphenoxy)acetyl]amino]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[[1-oxo-2-(4-propan-2-ylphenoxy)ethyl]hydrazo]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[[2-(4-propan-2-ylphenoxy)acetyl]amino]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[[[2-(4-isopropylphenoxy)acetyl]amino]thiocarbamoyl]-2-furamide Formula: C17H18BrN3O4S MolecularWeight: 440.31152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18BrN3O4S/c1-10(2)11-3-5-12(6-4-11)24-9-15(22)20-21-17(26)19-16(23)13-7-8-14(18)25-13/h3-8,10H,9H2,1-2H3,(H,20,22)(H2,19,21,23,26)