[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl-methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: [3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl-methyl-(pyridin-3-ylmethyl)azanium Openeye Name: [3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl-methyl-(3-pyridylmethyl)ammonium CAS Name: [3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)-4-imidazolyl]methyl-methyl-(3-pyridinylmethyl)ammonium IUPAC Name: [3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl-methyl-(pyridin-3-ylmethyl)azanium Traditional Name: [3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl-methyl-(3-pyridylmethyl)ammonium Formula: C22H33N4O2S+ MolecularWeight: 417.58802

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CN=CC=C1)CC2=CN=C(N2CC3CCCCC3)S(=O)(=O)CC4CC4

Isomeric SMILES

C[NH+](CC1=CN=CC=C1)CC2=CN=C(N2CC3CCCCC3)S(=O)(=O)CC4CC4

InChI

InChI=1S/C22H32N4O2S/c1-25(14-20-8-5-11-23-12-20)16-21-13-24-22(29(27,28)17-19-9-10-19)26(21)15-18-6-3-2-4-7-18/h5,8,11-13,18-19H,2-4,6-7,9-10,14-17H2,1H3/p+1