ethyl (E)-2-diethoxyphosphoryl-3-pyridin-4-yl-prop-2-enedithioate

Systemtic Name: ethyl (E)-2-diethoxyphosphoryl-3-pyridin-4-yl-prop-2-enedithioate Openeye Name: ethyl (E)-2-diethoxyphosphoryl-3-(4-pyridyl)prop-2-enedithioate CAS Name: (E)-2-diethoxyphosphoryl-3-pyridin-4-yl-2-propenedithioic acid ethyl ester IUPAC Name: ethyl (E)-2-diethoxyphosphoryl-3-pyridin-4-ylprop-2-enedithioate Traditional Name: (E)-2-diethoxyphosphoryl-3-(4-pyridyl)prop-2-enedithioic acid ethyl ester Formula: C14H20NO3PS2 MolecularWeight: 345.417261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(=CC1=CC=NC=C1)C(=S)SCC)OCC

Isomeric SMILES

CCOP(=O)(/C(=C/C1=CC=NC=C1)/C(=S)SCC)OCC

InChI

InChI=1S/C14H20NO3PS2/c1-4-17-19(16,18-5-2)13(14(20)21-6-3)11-12-7-9-15-10-8-12/h7-11H,4-6H2,1-3H3/b13-11+