3-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]propyl-dimethyl-azanium Openeye Name: 3-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-(1,3-benzothiazol-2-ylthio)acetyl]amino]propyl-dimethyl-ammonium Formula: C14H20N3OS2+ MolecularWeight: 310.4581

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)CSC1=NC2=CC=CC=C2S1

Isomeric SMILES

C[NH+](C)CCCNC(=O)CSC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C14H19N3OS2/c1-17(2)9-5-8-15-13(18)10-19-14-16-11-6-3-4-7-12(11)20-14/h3-4,6-7H,5,8-10H2,1-2H3,(H,15,18)/p+1