4-fluoranyl-N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 4-fluoranyl-N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 4-fluoro-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]benzamide CAS Name: 4-fluoro-N-[[[(4-hexoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-fluoro-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: 4-fluoro-N-[[(4-hexoxybenzoyl)amino]thiocarbamoyl]benzamide Formula: C21H24FN3O3S MolecularWeight: 417.496963

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C21H24FN3O3S/c1-2-3-4-5-14-28-18-12-8-16(9-13-18)20(27)24-25-21(29)23-19(26)15-6-10-17(22)11-7-15/h6-13H,2-5,14H2,1H3,(H,24,27)(H2,23,25,26,29)