N-[(butanoylamino)carbamothioyl]-2-fluoranyl-benzamide

Systemtic Name: N-[(butanoylamino)carbamothioyl]-2-fluoranyl-benzamide Openeye Name: N-[(butanoylamino)carbamothioyl]-2-fluoro-benzamide CAS Name: 2-fluoro-N-[(1-oxobutylhydrazo)-sulfanylidenemethyl]benzamide IUPAC Name: N-[(butanoylamino)carbamothioyl]-2-fluorobenzamide Traditional Name: N-(butyramidothiocarbamoyl)-2-fluoro-benzamide Formula: C12H14FN3O2S MolecularWeight: 283.321863

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NNC(=S)NC(=O)C1=CC=CC=C1F

Isomeric SMILES

CCCC(=O)NNC(=S)NC(=O)C1=CC=CC=C1F

InChI

InChI=1S/C12H14FN3O2S/c1-2-5-10(17)15-16-12(19)14-11(18)8-6-3-4-7-9(8)13/h3-4,6-7H,2,5H2,1H3,(H,15,17)(H2,14,16,18,19)