1-ethyl-4-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-1,2,3,4-tetrazole-5-thione

Systemtic Name: 1-ethyl-4-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-1,2,3,4-tetrazole-5-thione Openeye Name: 1-ethyl-4-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]tetrazole-5-thione CAS Name: 1-ethyl-4-[[4-(4-fluorophenyl)-1-piperazin-1-iumyl]methyl]-5-tetrazolethione IUPAC Name: 1-ethyl-4-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]tetrazole-5-thione Traditional Name: 1-ethyl-4-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]tetrazole-5-thione Formula: C14H20FN6S+ MolecularWeight: 323.412203

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=S)N(N=N1)C[NH+]2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

CCN1C(=S)N(N=N1)C[NH+]2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C14H19FN6S/c1-2-20-14(22)21(17-16-20)11-18-7-9-19(10-8-18)13-5-3-12(15)4-6-13/h3-6H,2,7-11H2,1H3/p+1