[3-(cyclohexylmethyl)-2-methylsulfonyl-imidazol-4-yl]methyl-methyl-[(1S)-1-pyrimidin-4-ylethyl]azanium

Systemtic Name: [3-(cyclohexylmethyl)-2-methylsulfonyl-imidazol-4-yl]methyl-methyl-[(1S)-1-pyrimidin-4-ylethyl]azanium Openeye Name: [3-(cyclohexylmethyl)-2-methylsulfonyl-imidazol-4-yl]methyl-methyl-[(1S)-1-pyrimidin-4-ylethyl]ammonium CAS Name: [3-(cyclohexylmethyl)-2-methylsulfonyl-4-imidazolyl]methyl-methyl-[(1S)-1-(4-pyrimidinyl)ethyl]ammonium IUPAC Name: [3-(cyclohexylmethyl)-2-methylsulfonylimidazol-4-yl]methyl-methyl-[(1S)-1-pyrimidin-4-ylethyl]azanium Traditional Name: [3-(cyclohexylmethyl)-2-mesyl-imidazol-4-yl]methyl-methyl-[(1S)-1-(4-pyrimidyl)ethyl]ammonium Formula: C19H30N5O2S+ MolecularWeight: 392.5388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C1=NC=NC=C1)[NH+](C)CC2=CN=C(N2CC3CCCCC3)S(=O)(=O)C

InChI

InChI=1S/C19H29N5O2S/c1-15(18-9-10-20-14-22-18)23(2)13-17-11-21-19(27(3,25)26)24(17)12-16-7-5-4-6-8-16/h9-11,14-16H,4-8,12-13H2,1-3H3/p+1/t15-/m0/s1