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

Systemtic Name: N-[(E)-2-(3-ethyl-4,5-dimethyl-1,3-thiazol-3-ium-2-yl)ethenyl]aniline iodide Openeye Name: N-[(E)-2-(3-ethyl-4,5-dimethyl-thiazol-3-ium-2-yl)vinyl]aniline iodide CAS Name: N-[(E)-2-(3-ethyl-4,5-dimethyl-2-thiazol-3-iumyl)ethenyl]aniline iodide IUPAC Name: N-[(E)-2-(3-ethyl-4,5-dimethyl-1,3-thiazol-3-ium-2-yl)ethenyl]aniline iodide Traditional Name: [(E)-2-(3-ethyl-4,5-dimethyl-thiazol-3-ium-2-yl)vinyl]-phenyl-amine iodide Formula: C15H19IN2S MolecularWeight: 386.29423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC(=C1C)C)C=CNC2=CC=CC=C2.[I-]

Isomeric SMILES

CC[N+]1=C(SC(=C1C)C)/C=C/NC2=CC=CC=C2.[I-]

InChI

InChI=1S/C15H18N2S.HI/c1-4-17-12(2)13(3)18-15(17)10-11-16-14-8-6-5-7-9-14;/h5-11H,4H2,1-3H3;1H