[(2R)-2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]propyl]-dimethyl-azanium

Systemtic Name: [(2R)-2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]propyl]-dimethyl-azanium Openeye Name: [(2R)-2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]propyl]-dimethyl-ammonium CAS Name: [(2R)-2-[(5-chloro-1,3-benzothiazol-2-yl)thio]propyl]-dimethylammonium IUPAC Name: [(2R)-2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]propyl]-dimethylazanium Traditional Name: [(2R)-2-[(5-chloro-1,3-benzothiazol-2-yl)thio]propyl]-dimethyl-ammonium Formula: C12H16ClN2S2+ MolecularWeight: 287.85184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+](C)C)SC1=NC2=C(S1)C=CC(=C2)Cl

Isomeric SMILES

C[C@H](C[NH+](C)C)SC1=NC2=C(S1)C=CC(=C2)Cl

InChI

InChI=1S/C12H15ClN2S2/c1-8(7-15(2)3)16-12-14-10-6-9(13)4-5-11(10)17-12/h4-6,8H,7H2,1-3H3/p+1/t8-/m1/s1