2-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]amino]ethyl-dimethyl-ammonium Formula: C13H20N3S+ MolecularWeight: 250.383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)NCC[NH+](C)C

Isomeric SMILES

C[C@@H](C1=NC2=CC=CC=C2S1)NCC[NH+](C)C

InChI

InChI=1S/C13H19N3S/c1-10(14-8-9-16(2)3)13-15-11-6-4-5-7-12(11)17-13/h4-7,10,14H,8-9H2,1-3H3/p+1/t10-/m0/s1