1-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl]-4-ethyl-piperazin-4-ium

Systemtic Name: 1-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl]-4-ethyl-piperazin-4-ium Openeye Name: 1-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl]-4-ethyl-piperazin-4-ium CAS Name: 1-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)-4-imidazolyl]methyl]-4-ethylpiperazin-4-ium IUPAC Name: 1-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl]-4-ethylpiperazin-4-ium Traditional Name: 1-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl]-4-ethyl-piperazin-4-ium Formula: C21H37N4O2S+ MolecularWeight: 409.60908

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=CN=C(N2CC3CCCCC3)S(=O)(=O)CC4CC4

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=CN=C(N2CC3CCCCC3)S(=O)(=O)CC4CC4

InChI

InChI=1S/C21H36N4O2S/c1-2-23-10-12-24(13-11-23)16-20-14-22-21(28(26,27)17-19-8-9-19)25(20)15-18-6-4-3-5-7-18/h14,18-19H,2-13,15-17H2,1H3/p+1