(2S)-1-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-methyl-2-propan-2-yl-piperazin-4-ium

Systemtic Name: (2S)-1-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-methyl-2-propan-2-yl-piperazin-4-ium Openeye Name: (2S)-1-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-isopropyl-4-methyl-piperazin-4-ium CAS Name: (2S)-1-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)-4-imidazolyl]methyl]-4-methyl-2-propan-2-ylpiperazin-4-ium IUPAC Name: (2S)-1-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-methyl-2-propan-2-ylpiperazin-4-ium Traditional Name: (2S)-1-[[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]-2-isopropyl-4-methyl-piperazin-4-ium Formula: C22H41N4O3S+ MolecularWeight: 441.65094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C[NH+](CCN1CC2=CN=C(N2CCOC)S(=O)(=O)CC3CCCCC3)C

Isomeric SMILES

CC(C)[C@H]1C[NH+](CCN1CC2=CN=C(N2CCOC)S(=O)(=O)CC3CCCCC3)C

InChI

InChI=1S/C22H40N4O3S/c1-18(2)21-16-24(3)10-11-25(21)15-20-14-23-22(26(20)12-13-29-4)30(27,28)17-19-8-6-5-7-9-19/h14,18-19,21H,5-13,15-17H2,1-4H3/p+1/t21-/m1/s1