5-[2,3-bis(chloranyl)phenyl]-N-(quinolin-8-ylcarbamothioyl)furan-2-carboxamide

Systemtic Name: 5-[2,3-bis(chloranyl)phenyl]-N-(quinolin-8-ylcarbamothioyl)furan-2-carboxamide Openeye Name: 5-(2,3-dichlorophenyl)-N-(8-quinolylcarbamothioyl)furan-2-carboxamide CAS Name: 5-(2,3-dichlorophenyl)-N-[(8-quinolinylamino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(2,3-dichlorophenyl)-N-(quinolin-8-ylcarbamothioyl)furan-2-carboxamide Traditional Name: 5-(2,3-dichlorophenyl)-N-(8-quinolylthiocarbamoyl)-2-furamide Formula: C21H13Cl2N3O2S MolecularWeight: 442.31782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NC(=S)NC(=O)C3=CC=C(O3)C4=C(C(=CC=C4)Cl)Cl)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)NC(=S)NC(=O)C3=CC=C(O3)C4=C(C(=CC=C4)Cl)Cl)N=CC=C2

InChI

InChI=1S/C21H13Cl2N3O2S/c22-14-7-2-6-13(18(14)23)16-9-10-17(28-16)20(27)26-21(29)25-15-8-1-4-12-5-3-11-24-19(12)15/h1-11H,(H2,25,26,27,29)