methyl-[(3-methylpyridin-4-yl)methyl]-[[2-methylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]azanium

Systemtic Name: methyl-[(3-methylpyridin-4-yl)methyl]-[[2-methylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]azanium Openeye Name: methyl-[(3-methyl-4-pyridyl)methyl]-[[2-methylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]ammonium CAS Name: methyl-[(3-methyl-4-pyridinyl)methyl]-[[2-methylsulfonyl-3-(3-phenylpropyl)-4-imidazolyl]methyl]ammonium IUPAC Name: methyl-[(3-methylpyridin-4-yl)methyl]-[[2-methylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]azanium Traditional Name: [2-mesyl-3-(3-phenylpropyl)imidazol-4-yl]methyl-methyl-[(3-methyl-4-pyridyl)methyl]ammonium Formula: C22H29N4O2S+ MolecularWeight: 413.55626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1)C[NH+](C)CC2=CN=C(N2CCCC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CN=C1)C[NH+](C)CC2=CN=C(N2CCCC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C22H28N4O2S/c1-18-14-23-12-11-20(18)16-25(2)17-21-15-24-22(29(3,27)28)26(21)13-7-10-19-8-5-4-6-9-19/h4-6,8-9,11-12,14-15H,7,10,13,16-17H2,1-3H3/p+1