2-fluoranyl-N-(4-methylpiperazin-4-ium-1-yl)carbothioyl-benzamide

Systemtic Name: 2-fluoranyl-N-(4-methylpiperazin-4-ium-1-yl)carbothioyl-benzamide Openeye Name: 2-fluoro-N-(4-methylpiperazin-4-ium-1-carbothioyl)benzamide CAS Name: 2-fluoro-N-[(4-methyl-1-piperazin-4-iumyl)-sulfanylidenemethyl]benzamide IUPAC Name: 2-fluoro-N-(4-methylpiperazin-4-ium-1-carbothioyl)benzamide Traditional Name: 2-fluoro-N-(4-methylpiperazin-4-ium-1-carbothioyl)benzamide Formula: C13H17FN3OS+ MolecularWeight: 282.356983

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=S)NC(=O)C2=CC=CC=C2F

Isomeric SMILES

C[NH+]1CCN(CC1)C(=S)NC(=O)C2=CC=CC=C2F

InChI

InChI=1S/C13H16FN3OS/c1-16-6-8-17(9-7-16)13(19)15-12(18)10-4-2-3-5-11(10)14/h2-5H,6-9H2,1H3,(H,15,18,19)/p+1