N-[(6-fluoranyl-1,3-benzothiazol-2-yl)carbamothioyl]pentanamide

Systemtic Name: N-[(6-fluoranyl-1,3-benzothiazol-2-yl)carbamothioyl]pentanamide Openeye Name: N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]pentanamide CAS Name: N-[[(6-fluoro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]pentanamide Traditional Name: N-[(6-fluoro-1,3-benzothiazol-2-yl)thiocarbamoyl]valeramide Formula: C13H14FN3OS2 MolecularWeight: 311.398163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=NC2=C(S1)C=C(C=C2)F

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=NC2=C(S1)C=C(C=C2)F

InChI

InChI=1S/C13H14FN3OS2/c1-2-3-4-11(18)16-12(19)17-13-15-9-6-5-8(14)7-10(9)20-13/h5-7H,2-4H2,1H3,(H2,15,16,17,18,19)