3-[(5,6-dimethyl-1,3-benzothiazol-2-yl)-thiophen-2-ylcarbonyl-amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(5,6-dimethyl-1,3-benzothiazol-2-yl)-thiophen-2-ylcarbonyl-amino]propyl-dimethyl-azanium Openeye Name: 3-[(5,6-dimethyl-1,3-benzothiazol-2-yl)-(thiophene-2-carbonyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[(5,6-dimethyl-1,3-benzothiazol-2-yl)-[oxo(thiophen-2-yl)methyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(5,6-dimethyl-1,3-benzothiazol-2-yl)-(thiophene-2-carbonyl)amino]propyl-dimethylazanium Traditional Name: 3-[(5,6-dimethyl-1,3-benzothiazol-2-yl)-(2-thenoyl)amino]propyl-dimethyl-ammonium Formula: C19H24N3OS2+ MolecularWeight: 374.54336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)N(CCC[NH+](C)C)C(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)N(CCC[NH+](C)C)C(=O)C3=CC=CS3

InChI

InChI=1S/C19H23N3OS2/c1-13-11-15-17(12-14(13)2)25-19(20-15)22(9-6-8-21(3)4)18(23)16-7-5-10-24-16/h5,7,10-12H,6,8-9H2,1-4H3/p+1