5-(4-bromophenyl)-N-(quinolin-5-ylcarbamothioyl)furan-2-carboxamide

Systemtic Name: 5-(4-bromophenyl)-N-(quinolin-5-ylcarbamothioyl)furan-2-carboxamide Openeye Name: 5-(4-bromophenyl)-N-(5-quinolylcarbamothioyl)furan-2-carboxamide CAS Name: 5-(4-bromophenyl)-N-[(5-quinolinylamino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(4-bromophenyl)-N-(quinolin-5-ylcarbamothioyl)furan-2-carboxamide Traditional Name: 5-(4-bromophenyl)-N-(5-quinolylthiocarbamoyl)-2-furamide Formula: C21H14BrN3O2S MolecularWeight: 452.32376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=N2)C(=C1)NC(=S)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC2=C(C=CC=N2)C(=C1)NC(=S)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H14BrN3O2S/c22-14-8-6-13(7-9-14)18-10-11-19(27-18)20(26)25-21(28)24-17-5-1-4-16-15(17)3-2-12-23-16/h1-12H,(H2,24,25,26,28)