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4-[4-(2-fluorophenyl)piperazin-4-ium-1-yl]carbothioylphenolate

4-[4-(2-fluorophenyl)piperazin-4-ium-1-yl]carbothioylphenolate

Systemtic Name:4-[4-(2-fluorophenyl)piperazin-4-ium-1-yl]carbothioylphenolate
Openeye Name:4-[4-(2-fluorophenyl)piperazin-4-ium-1-carbothioyl]phenolate
CAS Name:4-[[4-(2-fluorophenyl)-1-piperazin-4-iumyl]-sulfanylidenemethyl]phenolate
IUPAC Name:4-[4-(2-fluorophenyl)piperazin-4-ium-1-carbothioyl]phenolate
Traditional Name:4-[4-(2-fluorophenyl)piperazin-4-ium-1-carbothioyl]phenolate
Formula: C17H17FN2OS
MolecularWeight: 316.393083
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2=CC=CC=C2F)C(=S)C3=CC=C(C=C3)[O-]


Isomeric SMILES

C1CN(CC[NH+]1C2=CC=CC=C2F)C(=S)C3=CC=C(C=C3)[O-]


InChI

InChI=1S/C17H17FN2OS/c18-15-3-1-2-4-16(15)19-9-11-20(12-10-19)17(22)13-5-7-14(21)8-6-13/h1-8,21H,9-12H2


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