[4-(dimethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]methyl-ethyl-(phenylmethyl)azanium

Systemtic Name: [4-(dimethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]methyl-ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[[4-(dimethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]methyl]-ethyl-ammonium CAS Name: [4-(dimethylsulfamoyl)-3,5-dimethyl-1-pyrazolyl]methyl-ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[4-(dimethylsulfamoyl)-3,5-dimethylpyrazol-1-yl]methyl]-ethylazanium Traditional Name: benzyl-[[4-(dimethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]methyl]-ethyl-ammonium Formula: C17H27N4O2S+ MolecularWeight: 351.48688

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CN2C(=C(C(=N2)C)S(=O)(=O)N(C)C)C

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CN2C(=C(C(=N2)C)S(=O)(=O)N(C)C)C

InChI

InChI=1S/C17H26N4O2S/c1-6-20(12-16-10-8-7-9-11-16)13-21-15(3)17(14(2)18-21)24(22,23)19(4)5/h7-11H,6,12-13H2,1-5H3/p+1