3-(2-propyl-2H-1,3-benzothiazol-3-yl)propanal bromide

Systemtic Name: 3-(2-propyl-2H-1,3-benzothiazol-3-yl)propanal bromide Openeye Name: 3-(2-propyl-2H-1,3-benzothiazol-3-yl)propanal bromide CAS Name: 3-(2-propyl-2H-1,3-benzothiazol-3-yl)propanal bromide IUPAC Name: 3-(2-propyl-2H-1,3-benzothiazol-3-yl)propanal bromide Traditional Name: 3-(2-propyl-2H-1,3-benzothiazol-3-yl)propionaldehyde bromide Formula: C13H17BrNOS- MolecularWeight: 315.24918

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1N(C2=CC=CC=C2S1)CCC=O.[Br-]

Isomeric SMILES

CCCC1N(C2=CC=CC=C2S1)CCC=O.[Br-]

InChI

InChI=1S/C13H17NOS.BrH/c1-2-6-13-14(9-5-10-15)11-7-3-4-8-12(11)16-13;/h3-4,7-8,10,13H,2,5-6,9H2,1H3;1H/p-1