3-ethyl-2-(5-methylselenophen-2-yl)-1,3-benzothiazol-3-ium iodide

Systemtic Name: 3-ethyl-2-(5-methylselenophen-2-yl)-1,3-benzothiazol-3-ium iodide Openeye Name: 3-ethyl-2-(5-methylselenophen-2-yl)-1,3-benzothiazol-3-ium iodide CAS Name: 3-ethyl-2-(5-methyl-2-selenophenyl)-1,3-benzothiazol-3-ium iodide IUPAC Name: 3-ethyl-2-(5-methylselenophen-2-yl)-1,3-benzothiazol-3-ium iodide Traditional Name: 3-ethyl-2-(5-methylselenophen-2-yl)-1,3-benzothiazol-3-ium iodide Formula: C14H14INSSe MolecularWeight: 434.19713

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC2=CC=CC=C21)C3=CC=C([Se]3)C.[I-]

Isomeric SMILES

CC[N+]1=C(SC2=CC=CC=C21)C3=CC=C([Se]3)C.[I-]

InChI

InChI=1S/C14H14NSSe.HI/c1-3-15-11-6-4-5-7-12(11)16-14(15)13-9-8-10(2)17-13;/h4-9H,3H2,1-2H3;1H/q+1;/p-1