3-[1,3-benzothiazol-2-yl(2,2-dimethylpropanoyl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[1,3-benzothiazol-2-yl(2,2-dimethylpropanoyl)amino]propyl-dimethyl-azanium Openeye Name: 3-[1,3-benzothiazol-2-yl(2,2-dimethylpropanoyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[1,3-benzothiazol-2-yl-(2,2-dimethyl-1-oxopropyl)amino]propyl-dimethylammonium IUPAC Name: 3-[1,3-benzothiazol-2-yl(2,2-dimethylpropanoyl)amino]propyl-dimethylazanium Traditional Name: 3-[1,3-benzothiazol-2-yl(pivaloyl)amino]propyl-dimethyl-ammonium Formula: C17H26N3OS+ MolecularWeight: 320.47284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N(CCC[NH+](C)C)C1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)(C)C(=O)N(CCC[NH+](C)C)C1=NC2=CC=CC=C2S1

InChI

InChI=1S/C17H25N3OS/c1-17(2,3)15(21)20(12-8-11-19(4)5)16-18-13-9-6-7-10-14(13)22-16/h6-7,9-10H,8,11-12H2,1-5H3/p+1