ethyl-[[2-(2-methylpropylsulfonyl)-3-(phenylmethyl)imidazol-4-yl]methyl]-(2-pyrazol-1-ylethyl)azanium

Systemtic Name: ethyl-[[2-(2-methylpropylsulfonyl)-3-(phenylmethyl)imidazol-4-yl]methyl]-(2-pyrazol-1-ylethyl)azanium Openeye Name: (3-benzyl-2-isobutylsulfonyl-imidazol-4-yl)methyl-ethyl-(2-pyrazol-1-ylethyl)ammonium CAS Name: ethyl-[[2-(2-methylpropylsulfonyl)-3-(phenylmethyl)-4-imidazolyl]methyl]-[2-(1-pyrazolyl)ethyl]ammonium IUPAC Name: [3-benzyl-2-(2-methylpropylsulfonyl)imidazol-4-yl]methyl-ethyl-(2-pyrazol-1-ylethyl)azanium Traditional Name: (3-benzyl-2-isobutylsulfonyl-imidazol-4-yl)methyl-ethyl-(2-pyrazol-1-ylethyl)ammonium Formula: C22H32N5O2S+ MolecularWeight: 430.58678

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCN1C=CC=N1)CC2=CN=C(N2CC3=CC=CC=C3)S(=O)(=O)CC(C)C

Isomeric SMILES

CC[NH+](CCN1C=CC=N1)CC2=CN=C(N2CC3=CC=CC=C3)S(=O)(=O)CC(C)C

InChI

InChI=1S/C22H31N5O2S/c1-4-25(13-14-26-12-8-11-24-26)17-21-15-23-22(30(28,29)18-19(2)3)27(21)16-20-9-6-5-7-10-20/h5-12,15,19H,4,13-14,16-18H2,1-3H3/p+1