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

Systemtic Name: 1-cyclohexyl-4-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-1,2,3,4-tetrazole-5-thione Openeye Name: 1-cyclohexyl-4-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]tetrazole-5-thione CAS Name: 1-cyclohexyl-4-[[4-(2-fluorophenyl)-1-piperazin-1-iumyl]methyl]-5-tetrazolethione IUPAC Name: 1-cyclohexyl-4-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]tetrazole-5-thione Traditional Name: 1-cyclohexyl-4-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]tetrazole-5-thione Formula: C18H26FN6S+ MolecularWeight: 377.502643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=S)N(N=N2)C[NH+]3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

C1CCC(CC1)N2C(=S)N(N=N2)C[NH+]3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C18H25FN6S/c19-16-8-4-5-9-17(16)23-12-10-22(11-13-23)14-24-18(26)25(21-20-24)15-6-2-1-3-7-15/h4-5,8-9,15H,1-3,6-7,10-14H2/p+1