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

Systemtic Name: [4-(diethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[4-(diethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]methyl]-methyl-ammonium CAS Name: [4-(diethylsulfamoyl)-3,5-dimethyl-1-pyrazolyl]methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[4-(diethylsulfamoyl)-3,5-dimethylpyrazol-1-yl]methyl]-methylazanium Traditional Name: benzyl-[[4-(diethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]methyl]-methyl-ammonium Formula: C18H29N4O2S+ MolecularWeight: 365.51346

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(N(N=C1C)C[NH+](C)CC2=CC=CC=C2)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(N(N=C1C)C[NH+](C)CC2=CC=CC=C2)C

InChI

InChI=1S/C18H28N4O2S/c1-6-21(7-2)25(23,24)18-15(3)19-22(16(18)4)14-20(5)13-17-11-9-8-10-12-17/h8-12H,6-7,13-14H2,1-5H3/p+1