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

Systemtic Name: 3-[1,3-benzothiazol-2-yl(propanoyl)amino]propyl-dimethyl-azanium Openeye Name: 3-[1,3-benzothiazol-2-yl(propanoyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[1,3-benzothiazol-2-yl(1-oxopropyl)amino]propyl-dimethylammonium IUPAC Name: 3-[1,3-benzothiazol-2-yl(propanoyl)amino]propyl-dimethylazanium Traditional Name: 3-[1,3-benzothiazol-2-yl(propionyl)amino]propyl-dimethyl-ammonium Formula: C15H22N3OS+ MolecularWeight: 292.41968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3OS/c1-4-14(19)18(11-7-10-17(2)3)15-16-12-8-5-6-9-13(12)20-15/h5-6,8-9H,4,7,10-11H2,1-3H3/p+1