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

Systemtic Name: 3-[1,3-benzothiazol-2-yl(ethanoyl)amino]propyl-dimethyl-azanium Openeye Name: 3-[acetyl(1,3-benzothiazol-2-yl)amino]propyl-dimethyl-ammonium CAS Name: 3-[acetyl(1,3-benzothiazol-2-yl)amino]propyl-dimethylammonium IUPAC Name: 3-[acetyl(1,3-benzothiazol-2-yl)amino]propyl-dimethylazanium Traditional Name: 3-[acetyl(1,3-benzothiazol-2-yl)amino]propyl-dimethyl-ammonium Formula: C14H20N3OS+ MolecularWeight: 278.3931

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3OS/c1-11(18)17(10-6-9-16(2)3)14-15-12-7-4-5-8-13(12)19-14/h4-5,7-8H,6,9-10H2,1-3H3/p+1