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

Systemtic Name: N-methyl-N-[(E)-2-(3-methyl-4,5-dihydro-1,3-thiazol-3-ium-2-yl)ethenyl]aniline iodide Openeye Name: N-methyl-N-[(E)-2-(3-methyl-4,5-dihydrothiazol-3-ium-2-yl)vinyl]aniline iodide CAS Name: N-methyl-N-[(E)-2-(3-methyl-4,5-dihydrothiazol-3-ium-2-yl)ethenyl]aniline iodide IUPAC Name: N-methyl-N-[(E)-2-(3-methyl-4,5-dihydro-1,3-thiazol-3-ium-2-yl)ethenyl]aniline iodide Traditional Name: methyl-[(E)-2-(3-methyl-2-thiazolin-3-ium-2-yl)vinyl]-phenyl-amine iodide Formula: C13H17IN2S MolecularWeight: 360.25695

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(SCC1)C=CN(C)C2=CC=CC=C2.[I-]

Isomeric SMILES

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

InChI

InChI=1S/C13H17N2S.HI/c1-14(12-6-4-3-5-7-12)9-8-13-15(2)10-11-16-13;/h3-9H,10-11H2,1-2H3;1H/q+1;/p-1