2,6-dimethyl-4-prop-2-enyl-pyrylium-3-thiol iodide

Systemtic Name: 2,6-dimethyl-4-prop-2-enyl-pyrylium-3-thiol iodide Openeye Name: 4-allyl-2,6-dimethyl-pyrylium-3-thiol iodide CAS Name: 2,6-dimethyl-4-prop-2-enyl-3-pyryliumthiol iodide IUPAC Name: 2,6-dimethyl-4-prop-2-enylpyrylium-3-thiol iodide Traditional Name: 4-allyl-2,6-dimethyl-pyrylium-3-thiol iodide Formula: C10H13IOS MolecularWeight: 308.17909

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[O+]C(=C(C(=C1)CC=C)S)C.[I-]

Isomeric SMILES

CC1=[O+]C(=C(C(=C1)CC=C)S)C.[I-]

InChI

InChI=1S/C10H12OS.HI/c1-4-5-9-6-7(2)11-8(3)10(9)12;/h4,6H,1,5H2,2-3H3;1H