3-fluoranyl-4-[(4-propylpiperazin-4-ium-1-yl)methyl]benzenecarbothioamide

Systemtic Name: 3-fluoranyl-4-[(4-propylpiperazin-4-ium-1-yl)methyl]benzenecarbothioamide Openeye Name: 3-fluoro-4-[(4-propylpiperazin-4-ium-1-yl)methyl]benzenecarbothioamide CAS Name: 3-fluoro-4-[(4-propyl-1-piperazin-4-iumyl)methyl]benzenecarbothioamide IUPAC Name: 3-fluoro-4-[(4-propylpiperazin-4-ium-1-yl)methyl]benzenecarbothioamide Traditional Name: 3-fluoro-4-[(4-propylpiperazin-4-ium-1-yl)methyl]thiobenzamide Formula: C15H23FN3S+ MolecularWeight: 296.426623

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)CC2=C(C=C(C=C2)C(=S)N)F

Isomeric SMILES

CCC[NH+]1CCN(CC1)CC2=C(C=C(C=C2)C(=S)N)F

InChI

InChI=1S/C15H22FN3S/c1-2-5-18-6-8-19(9-7-18)11-13-4-3-12(15(17)20)10-14(13)16/h3-4,10H,2,5-9,11H2,1H3,(H2,17,20)/p+1