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

Systemtic Name: 2-[(6-bromanyl-1,3-benzothiazol-2-yl)-thiophen-2-ylcarbonyl-amino]ethyl-dimethyl-azanium Openeye Name: 2-[(6-bromo-1,3-benzothiazol-2-yl)-(thiophene-2-carbonyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(6-bromo-1,3-benzothiazol-2-yl)-[oxo(thiophen-2-yl)methyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(6-bromo-1,3-benzothiazol-2-yl)-(thiophene-2-carbonyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(6-bromo-1,3-benzothiazol-2-yl)-(2-thenoyl)amino]ethyl-dimethyl-ammonium Formula: C16H17BrN3OS2+ MolecularWeight: 411.35968

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN(C1=NC2=C(S1)C=C(C=C2)Br)C(=O)C3=CC=CS3

Isomeric SMILES

C[NH+](C)CCN(C1=NC2=C(S1)C=C(C=C2)Br)C(=O)C3=CC=CS3

InChI

InChI=1S/C16H16BrN3OS2/c1-19(2)7-8-20(15(21)13-4-3-9-22-13)16-18-12-6-5-11(17)10-14(12)23-16/h3-6,9-10H,7-8H2,1-2H3/p+1