6-carbamothioyl-N-[(4-chlorophenyl)methyl]-8-fluoranyl-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: 6-carbamothioyl-N-[(4-chlorophenyl)methyl]-8-fluoranyl-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: 6-carbamothioyl-N-[(4-chlorophenyl)methyl]-8-fluoro-4-oxo-1H-quinoline-3-carboxamide CAS Name: 6-carbamothioyl-N-[(4-chlorophenyl)methyl]-8-fluoro-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: 6-carbamothioyl-N-[(4-chlorophenyl)methyl]-8-fluoro-4-oxo-1H-quinoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-8-fluoro-4-keto-6-thiocarbamoyl-1H-quinoline-3-carboxamide Formula: C18H13ClFN3O2S MolecularWeight: 389.831123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CNC3=C(C=C(C=C3C2=O)C(=S)N)F)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CNC3=C(C=C(C=C3C2=O)C(=S)N)F)Cl

InChI

InChI=1S/C18H13ClFN3O2S/c19-11-3-1-9(2-4-11)7-23-18(25)13-8-22-15-12(16(13)24)5-10(17(21)26)6-14(15)20/h1-6,8H,7H2,(H2,21,26)(H,22,24)(H,23,25)