5-bromanyl-N-[[2-(prop-2-enylcarbamoyl)phenyl]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[[2-(prop-2-enylcarbamoyl)phenyl]carbamothioyl]furan-2-carboxamide Openeye Name: N-[[2-(allylcarbamoyl)phenyl]carbamothioyl]-5-bromo-furan-2-carboxamide CAS Name: 5-bromo-N-[[2-[oxo-(prop-2-enylamino)methyl]anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[2-(prop-2-enylcarbamoyl)phenyl]carbamothioyl]furan-2-carboxamide Traditional Name: N-[[2-(allylcarbamoyl)phenyl]thiocarbamoyl]-5-bromo-2-furamide Formula: C16H14BrN3O3S MolecularWeight: 408.26966

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC=C(O2)Br

Isomeric SMILES

C=CCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C16H14BrN3O3S/c1-2-9-18-14(21)10-5-3-4-6-11(10)19-16(24)20-15(22)12-7-8-13(17)23-12/h2-8H,1,9H2,(H,18,21)(H2,19,20,22,24)