[(1R)-2-[[5-(diethylsulfamoyl)-2-methyl-phenyl]carbamothioylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[[5-(diethylsulfamoyl)-2-methyl-phenyl]carbamothioylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[[5-(diethylsulfamoyl)-2-methyl-phenyl]carbamothioylamino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[[5-(diethylsulfamoyl)-2-methylanilino]-sulfanylidenemethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1R)-2-[[5-(diethylsulfamoyl)-2-methylphenyl]carbamothioylamino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1R)-2-[[5-(diethylsulfamoyl)-2-methyl-phenyl]thiocarbamoylamino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C22H33N4O2S2+ MolecularWeight: 449.65302

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=S)NCC(C2=CC=CC=C2)[NH+](C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=S)NC[C@@H](C2=CC=CC=C2)[NH+](C)C

InChI

InChI=1S/C22H32N4O2S2/c1-6-26(7-2)30(27,28)19-14-13-17(3)20(15-19)24-22(29)23-16-21(25(4)5)18-11-9-8-10-12-18/h8-15,21H,6-7,16H2,1-5H3,(H2,23,24,29)/p+1/t21-/m0/s1