N-[(3-ethoxypropanoylamino)carbamothioyl]-4-fluoranyl-benzamide

Systemtic Name: N-[(3-ethoxypropanoylamino)carbamothioyl]-4-fluoranyl-benzamide Openeye Name: N-[(3-ethoxypropanoylamino)carbamothioyl]-4-fluoro-benzamide CAS Name: N-[[(3-ethoxy-1-oxopropyl)hydrazo]-sulfanylidenemethyl]-4-fluorobenzamide IUPAC Name: N-[(3-ethoxypropanoylamino)carbamothioyl]-4-fluorobenzamide Traditional Name: N-[(3-ethoxypropanoylamino)thiocarbamoyl]-4-fluoro-benzamide Formula: C13H16FN3O3S MolecularWeight: 313.347843

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCC(=O)NNC(=S)NC(=O)C1=CC=C(C=C1)F

Isomeric SMILES

CCOCCC(=O)NNC(=S)NC(=O)C1=CC=C(C=C1)F

InChI

InChI=1S/C13H16FN3O3S/c1-2-20-8-7-11(18)16-17-13(21)15-12(19)9-3-5-10(14)6-4-9/h3-6H,2,7-8H2,1H3,(H,16,18)(H2,15,17,19,21)