2-(3,5-dimethylpyrazol-1-yl)ethyl-methyl-[(3-phenethyl-2-propan-2-ylsulfonyl-imidazol-4-yl)methyl]azanium

Systemtic Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-methyl-[(3-phenethyl-2-propan-2-ylsulfonyl-imidazol-4-yl)methyl]azanium Openeye Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-[(2-isopropylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-methyl-ammonium CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)ethyl-methyl-[(3-phenethyl-2-propan-2-ylsulfonyl-4-imidazolyl)methyl]ammonium IUPAC Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-methyl-[(3-phenethyl-2-propan-2-ylsulfonylimidazol-4-yl)methyl]azanium Traditional Name: 2-(3,5-dimethylpyrazol-1-yl)ethyl-[(2-isopropylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-methyl-ammonium Formula: C23H34N5O2S+ MolecularWeight: 444.61336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC[NH+](C)CC2=CN=C(N2CCC3=CC=CC=C3)S(=O)(=O)C(C)C)C

Isomeric SMILES

CC1=CC(=NN1CC[NH+](C)CC2=CN=C(N2CCC3=CC=CC=C3)S(=O)(=O)C(C)C)C

InChI

InChI=1S/C23H33N5O2S/c1-18(2)31(29,30)23-24-16-22(27(23)12-11-21-9-7-6-8-10-21)17-26(5)13-14-28-20(4)15-19(3)25-28/h6-10,15-16,18H,11-14,17H2,1-5H3/p+1