5-bromanyl-N-[methyl-[2-(phenethylcarbamoyl)phenyl]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[methyl-[2-(phenethylcarbamoyl)phenyl]carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[methyl-[2-(phenethylcarbamoyl)phenyl]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[N-methyl-2-[oxo-(phenethylamino)methyl]anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[methyl-[2-(phenethylcarbamoyl)phenyl]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[methyl-[2-(phenethylcarbamoyl)phenyl]thiocarbamoyl]-2-furamide Formula: C22H20BrN3O3S MolecularWeight: 486.3815

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NCCC2=CC=CC=C2)C(=S)NC(=O)C3=CC=C(O3)Br

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NCCC2=CC=CC=C2)C(=S)NC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C22H20BrN3O3S/c1-26(22(30)25-21(28)18-11-12-19(23)29-18)17-10-6-5-9-16(17)20(27)24-14-13-15-7-3-2-4-8-15/h2-12H,13-14H2,1H3,(H,24,27)(H,25,28,30)