3-ethylsulfanyl-2-(4-methylpyridin-1-ium-1-yl)-1-phenyl-3-sulfanyl-prop-2-en-1-one

Systemtic Name: 3-ethylsulfanyl-2-(4-methylpyridin-1-ium-1-yl)-1-phenyl-3-sulfanyl-prop-2-en-1-one Openeye Name: 3-ethylsulfanyl-2-(4-methylpyridin-1-ium-1-yl)-1-phenyl-3-sulfanyl-prop-2-en-1-one CAS Name: 3-(ethylthio)-3-mercapto-2-(4-methyl-1-pyridin-1-iumyl)-1-phenyl-2-propen-1-one IUPAC Name: 3-ethylsulfanyl-2-(4-methylpyridin-1-ium-1-yl)-1-phenyl-3-sulfanylprop-2-en-1-one Traditional Name: 3-(ethylthio)-3-mercapto-2-(4-methylpyridin-1-ium-1-yl)-1-phenyl-prop-2-en-1-one Formula: C17H18NOS2+ MolecularWeight: 316.46092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(=C(C(=O)C1=CC=CC=C1)[N+]2=CC=C(C=C2)C)S

Isomeric SMILES

CCSC(=C(C(=O)C1=CC=CC=C1)[N+]2=CC=C(C=C2)C)S

InChI

InChI=1S/C17H17NOS2/c1-3-21-17(20)15(18-11-9-13(2)10-12-18)16(19)14-7-5-4-6-8-14/h4-12H,3H2,1-2H3/p+1