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

Systemtic Name: 1-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-4-cyclohexyl-1,2,3,4-tetrazole-5-thione Openeye Name: 1-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-4-cyclohexyl-tetrazole-5-thione CAS Name: 1-[[4-(3-chlorophenyl)-1-piperazin-1-iumyl]methyl]-4-cyclohexyl-5-tetrazolethione IUPAC Name: 1-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-4-cyclohexyltetrazole-5-thione Traditional Name: 1-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-4-cyclohexyl-tetrazole-5-thione Formula: C18H26ClN6S+ MolecularWeight: 393.95724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25ClN6S/c19-15-5-4-8-17(13-15)23-11-9-22(10-12-23)14-24-18(26)25(21-20-24)16-6-2-1-3-7-16/h4-5,8,13,16H,1-3,6-7,9-12,14H2/p+1