[3-[2,1,3-benzothiadiazol-4-ylsulfonyl(2-cyanoethyl)amino]-2,2-dimethyl-propyl]-dimethyl-azanium

Systemtic Name: [3-[2,1,3-benzothiadiazol-4-ylsulfonyl(2-cyanoethyl)amino]-2,2-dimethyl-propyl]-dimethyl-azanium Openeye Name: [3-[2,1,3-benzothiadiazol-4-ylsulfonyl(2-cyanoethyl)amino]-2,2-dimethyl-propyl]-dimethyl-ammonium CAS Name: [3-[2,1,3-benzothiadiazol-4-ylsulfonyl(2-cyanoethyl)amino]-2,2-dimethylpropyl]-dimethylammonium IUPAC Name: [3-[2,1,3-benzothiadiazol-4-ylsulfonyl(2-cyanoethyl)amino]-2,2-dimethylpropyl]-dimethylazanium Traditional Name: [3-[2-cyanoethyl(piazthiol-4-ylsulfonyl)amino]-2,2-dimethyl-propyl]-dimethyl-ammonium Formula: C16H24N5O2S2+ MolecularWeight: 382.52406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH+](C)C)CN(CCC#N)S(=O)(=O)C1=CC=CC2=NSN=C21

Isomeric SMILES

CC(C)(C[NH+](C)C)CN(CCC#N)S(=O)(=O)C1=CC=CC2=NSN=C21

InChI

InChI=1S/C16H23N5O2S2/c1-16(2,11-20(3)4)12-21(10-6-9-17)25(22,23)14-8-5-7-13-15(14)19-24-18-13/h5,7-8H,6,10-12H2,1-4H3/p+1