2-(1,3-benzothiazol-3-ium-3-yl)-N-(2,6-diethylphenyl)ethanamide bromide

Systemtic Name: 2-(1,3-benzothiazol-3-ium-3-yl)-N-(2,6-diethylphenyl)ethanamide bromide Openeye Name: 2-(1,3-benzothiazol-3-ium-3-yl)-N-(2,6-diethylphenyl)acetamide bromide CAS Name: 2-(1,3-benzothiazol-3-ium-3-yl)-N-(2,6-diethylphenyl)acetamide bromide IUPAC Name: 2-(1,3-benzothiazol-3-ium-3-yl)-N-(2,6-diethylphenyl)acetamide bromide Traditional Name: 2-(1,3-benzothiazol-3-ium-3-yl)-N-(2,6-diethylphenyl)acetamide bromide Formula: C19H21BrN2OS MolecularWeight: 405.35184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C[N+]2=CSC3=CC=CC=C32.[Br-]

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)C[N+]2=CSC3=CC=CC=C32.[Br-]

InChI

InChI=1S/C19H20N2OS.BrH/c1-3-14-8-7-9-15(4-2)19(14)20-18(22)12-21-13-23-17-11-6-5-10-16(17)21;/h5-11,13H,3-4,12H2,1-2H3;1H