3-[(4-ethoxy-1,3-benzothiazol-2-yl)-thiophen-2-ylcarbonyl-amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(4-ethoxy-1,3-benzothiazol-2-yl)-thiophen-2-ylcarbonyl-amino]propyl-dimethyl-azanium Openeye Name: 3-[(4-ethoxy-1,3-benzothiazol-2-yl)-(thiophene-2-carbonyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[(4-ethoxy-1,3-benzothiazol-2-yl)-[oxo(thiophen-2-yl)methyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(4-ethoxy-1,3-benzothiazol-2-yl)-(thiophene-2-carbonyl)amino]propyl-dimethylazanium Traditional Name: 3-[(4-ethoxy-1,3-benzothiazol-2-yl)-(2-thenoyl)amino]propyl-dimethyl-ammonium Formula: C19H24N3O2S2+ MolecularWeight: 390.54276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=N2)N(CCC[NH+](C)C)C(=O)C3=CC=CS3

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=N2)N(CCC[NH+](C)C)C(=O)C3=CC=CS3

InChI

InChI=1S/C19H23N3O2S2/c1-4-24-14-8-5-9-15-17(14)20-19(26-15)22(12-7-11-21(2)3)18(23)16-10-6-13-25-16/h5-6,8-10,13H,4,7,11-12H2,1-3H3/p+1