N-(4-ethanoylpiperazin-1-yl)carbothioyl-4-fluoranyl-benzamide

Systemtic Name: N-(4-ethanoylpiperazin-1-yl)carbothioyl-4-fluoranyl-benzamide Openeye Name: N-(4-acetylpiperazine-1-carbothioyl)-4-fluoro-benzamide CAS Name: N-[(4-acetyl-1-piperazinyl)-sulfanylidenemethyl]-4-fluorobenzamide IUPAC Name: N-(4-acetylpiperazine-1-carbothioyl)-4-fluorobenzamide Traditional Name: N-(4-acetylpiperazine-1-carbothioyl)-4-fluoro-benzamide Formula: C14H16FN3O2S MolecularWeight: 309.359143

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=S)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=S)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C14H16FN3O2S/c1-10(19)17-6-8-18(9-7-17)14(21)16-13(20)11-2-4-12(15)5-3-11/h2-5H,6-9H2,1H3,(H,16,20,21)