[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-ethyl-[(1-methylpyrazol-4-yl)methyl]azanium

Systemtic Name: [2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-ethyl-[(1-methylpyrazol-4-yl)methyl]azanium Openeye Name: [2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-ethyl-[(1-methylpyrazol-4-yl)methyl]ammonium CAS Name: [2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)-4-imidazolyl]methyl-ethyl-[(1-methyl-4-pyrazolyl)methyl]ammonium IUPAC Name: [2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-ethyl-[(1-methylpyrazol-4-yl)methyl]azanium Traditional Name: [2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-ethyl-[(1-methylpyrazol-4-yl)methyl]ammonium Formula: C21H36N5O3S+ MolecularWeight: 438.60724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CN=C(N1CCOC)S(=O)(=O)CC2CCCCC2)CC3=CN(N=C3)C

Isomeric SMILES

CC[NH+](CC1=CN=C(N1CCOC)S(=O)(=O)CC2CCCCC2)CC3=CN(N=C3)C

InChI

InChI=1S/C21H35N5O3S/c1-4-25(15-19-12-23-24(2)14-19)16-20-13-22-21(26(20)10-11-29-3)30(27,28)17-18-8-6-5-7-9-18/h12-14,18H,4-11,15-17H2,1-3H3/p+1