N-[(E)-2-(3-ethyl-4,5-dihydro-1,3-thiazol-3-ium-2-yl)ethenyl]aniline bromide

Systemtic Name: N-[(E)-2-(3-ethyl-4,5-dihydro-1,3-thiazol-3-ium-2-yl)ethenyl]aniline bromide Openeye Name: N-[(E)-2-(3-ethyl-4,5-dihydrothiazol-3-ium-2-yl)vinyl]aniline bromide CAS Name: N-[(E)-2-(3-ethyl-4,5-dihydrothiazol-3-ium-2-yl)ethenyl]aniline bromide IUPAC Name: N-[(E)-2-(3-ethyl-4,5-dihydro-1,3-thiazol-3-ium-2-yl)ethenyl]aniline bromide Traditional Name: [(E)-2-(3-ethyl-2-thiazolin-3-ium-2-yl)vinyl]-phenyl-amine bromide Formula: C13H17BrN2S MolecularWeight: 313.25648

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SCC1)C=CNC2=CC=CC=C2.[Br-]

Isomeric SMILES

CC[N+]1=C(SCC1)/C=C/NC2=CC=CC=C2.[Br-]

InChI

InChI=1S/C13H16N2S.BrH/c1-2-15-10-11-16-13(15)8-9-14-12-6-4-3-5-7-12;/h3-9H,2,10-11H2,1H3;1H