5-bromanyl-N-[(2,2-diphenylethanoylamino)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[(2,2-diphenylethanoylamino)carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[[(2,2-diphenylacetyl)amino]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[(1-oxo-2,2-diphenylethyl)hydrazo]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[(2,2-diphenylacetyl)amino]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[[(2,2-diphenylacetyl)amino]thiocarbamoyl]-2-furamide Formula: C20H16BrN3O3S MolecularWeight: 458.32834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NNC(=S)NC(=O)C3=CC=C(O3)Br

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NNC(=S)NC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C20H16BrN3O3S/c21-16-12-11-15(27-16)18(25)22-20(28)24-23-19(26)17(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-12,17H,(H,23,26)(H2,22,24,25,28)