2-[(2-azanyl-1,3-benzothiazol-5-yl)carbonyl-methyl-amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(2-azanyl-1,3-benzothiazol-5-yl)carbonyl-methyl-amino]ethyl-dimethyl-azanium Openeye Name: 2-[(2-amino-1,3-benzothiazole-5-carbonyl)-methyl-amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(2-amino-1,3-benzothiazol-5-yl)-oxomethyl]-methylamino]ethyl-dimethylammonium IUPAC Name: 2-[(2-amino-1,3-benzothiazole-5-carbonyl)-methylamino]ethyl-dimethylazanium Traditional Name: 2-[(2-amino-1,3-benzothiazole-5-carbonyl)-methyl-amino]ethyl-dimethyl-ammonium Formula: C13H19N4OS+ MolecularWeight: 279.38116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN(C)C(=O)C1=CC2=C(C=C1)SC(=N2)N

Isomeric SMILES

C[NH+](C)CCN(C)C(=O)C1=CC2=C(C=C1)SC(=N2)N

InChI

InChI=1S/C13H18N4OS/c1-16(2)6-7-17(3)12(18)9-4-5-11-10(8-9)15-13(14)19-11/h4-5,8H,6-7H2,1-3H3,(H2,14,15)/p+1