N-[[2-(4-fluorophenyl)quinolin-4-yl]carbamothioyl]benzamide

Systemtic Name: N-[[2-(4-fluorophenyl)quinolin-4-yl]carbamothioyl]benzamide Openeye Name: N-[[2-(4-fluorophenyl)-4-quinolyl]carbamothioyl]benzamide CAS Name: N-[[[2-(4-fluorophenyl)-4-quinolinyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[2-(4-fluorophenyl)quinolin-4-yl]carbamothioyl]benzamide Traditional Name: N-[[2-(4-fluorophenyl)-4-quinolyl]thiocarbamoyl]benzamide Formula: C23H16FN3OS MolecularWeight: 401.456043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H16FN3OS/c24-17-12-10-15(11-13-17)20-14-21(18-8-4-5-9-19(18)25-20)26-23(29)27-22(28)16-6-2-1-3-7-16/h1-14H,(H2,25,26,27,28,29)