N-[2,4-bis(fluoranyl)phenyl]-4-propyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-4-propyl-piperazin-4-ium-1-carbothioamide Openeye Name: N-(2,4-difluorophenyl)-4-propyl-piperazin-4-ium-1-carbothioamide CAS Name: N-(2,4-difluorophenyl)-4-propyl-1-piperazin-4-iumcarbothioamide IUPAC Name: N-(2,4-difluorophenyl)-4-propylpiperazin-4-ium-1-carbothioamide Traditional Name: N-(2,4-difluorophenyl)-4-propyl-piperazin-4-ium-1-carbothioamide Formula: C14H20F2N3S+ MolecularWeight: 300.390506

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(=S)NC2=C(C=C(C=C2)F)F

Isomeric SMILES

CCC[NH+]1CCN(CC1)C(=S)NC2=C(C=C(C=C2)F)F

InChI

InChI=1S/C14H19F2N3S/c1-2-5-18-6-8-19(9-7-18)14(20)17-13-4-3-11(15)10-12(13)16/h3-4,10H,2,5-9H2,1H3,(H,17,20)/p+1