N-[[(4-benzamidophenyl)carbonylamino]carbamothioyl]-2-fluoranyl-benzamide

Systemtic Name: N-[[(4-benzamidophenyl)carbonylamino]carbamothioyl]-2-fluoranyl-benzamide Openeye Name: N-[[(4-benzamidobenzoyl)amino]carbamothioyl]-2-fluoro-benzamide CAS Name: N-[[[(4-benzamidophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-fluorobenzamide IUPAC Name: N-[[(4-benzamidobenzoyl)amino]carbamothioyl]-2-fluorobenzamide Traditional Name: N-[[(4-benzamidobenzoyl)amino]thiocarbamoyl]-2-fluoro-benzamide Formula: C22H17FN4O3S MolecularWeight: 436.458783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H17FN4O3S/c23-18-9-5-4-8-17(18)21(30)25-22(31)27-26-20(29)15-10-12-16(13-11-15)24-19(28)14-6-2-1-3-7-14/h1-13H,(H,24,28)(H,26,29)(H2,25,27,30,31)