2-[(2S)-1-[[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]pyrrolidin-1-ium-2-yl]pyridine

Systemtic Name: 2-[(2S)-1-[[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]pyrrolidin-1-ium-2-yl]pyridine Openeye Name: 2-[(2S)-1-[(3-isobutyl-2-methylsulfonyl-imidazol-4-yl)methyl]pyrrolidin-1-ium-2-yl]pyridine CAS Name: 2-[(2S)-1-[[3-(2-methylpropyl)-2-methylsulfonyl-4-imidazolyl]methyl]-2-pyrrolidin-1-iumyl]pyridine IUPAC Name: 2-[(2S)-1-[[3-(2-methylpropyl)-2-methylsulfonylimidazol-4-yl]methyl]pyrrolidin-1-ium-2-yl]pyridine Traditional Name: 2-[(2S)-1-[(3-isobutyl-2-mesyl-imidazol-4-yl)methyl]pyrrolidin-1-ium-2-yl]pyridine Formula: C18H27N4O2S+ MolecularWeight: 363.49758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CN=C1S(=O)(=O)C)C[NH+]2CCCC2C3=CC=CC=N3

Isomeric SMILES

CC(C)CN1C(=CN=C1S(=O)(=O)C)C[NH+]2CCC[C@H]2C3=CC=CC=N3

InChI

InChI=1S/C18H26N4O2S/c1-14(2)12-22-15(11-20-18(22)25(3,23)24)13-21-10-6-8-17(21)16-7-4-5-9-19-16/h4-5,7,9,11,14,17H,6,8,10,12-13H2,1-3H3/p+1/t17-/m0/s1