diethyl-[3-[[3-(phenylsulfonylmethyl)-1,2,4-oxadiazol-5-yl]carbonylamino]propyl]azanium

Systemtic Name: diethyl-[3-[[3-(phenylsulfonylmethyl)-1,2,4-oxadiazol-5-yl]carbonylamino]propyl]azanium Openeye Name: 3-[[3-(benzenesulfonylmethyl)-1,2,4-oxadiazole-5-carbonyl]amino]propyl-diethyl-ammonium CAS Name: 3-[[[3-(benzenesulfonylmethyl)-1,2,4-oxadiazol-5-yl]-oxomethyl]amino]propyl-diethylammonium IUPAC Name: 3-[[3-(benzenesulfonylmethyl)-1,2,4-oxadiazole-5-carbonyl]amino]propyl-diethylazanium Traditional Name: 3-[[3-(besylmethyl)-1,2,4-oxadiazole-5-carbonyl]amino]propyl-diethyl-ammonium Formula: C17H25N4O4S+ MolecularWeight: 381.4698

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)C1=NC(=NO1)CS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)C1=NC(=NO1)CS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H24N4O4S/c1-3-21(4-2)12-8-11-18-16(22)17-19-15(20-25-17)13-26(23,24)14-9-6-5-7-10-14/h5-7,9-10H,3-4,8,11-13H2,1-2H3,(H,18,22)/p+1