ethyl 2-[6-dimethoxyphosphinothioyloxy-2-(ethylamino)pyrimidin-4-yl]ethanoate

Systemtic Name: ethyl 2-[6-dimethoxyphosphinothioyloxy-2-(ethylamino)pyrimidin-4-yl]ethanoate Openeye Name: ethyl 2-[6-dimethoxyphosphinothioyloxy-2-(ethylamino)pyrimidin-4-yl]acetate CAS Name: 2-[6-dimethoxyphosphinothioyloxy-2-(ethylamino)-4-pyrimidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-dimethoxyphosphinothioyloxy-2-(ethylamino)pyrimidin-4-yl]acetate Traditional Name: 2-[6-dimethoxythiophosphoryloxy-2-(ethylamino)pyrimidin-4-yl]acetic acid ethyl ester Formula: C12H20N3O5PS MolecularWeight: 349.343061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=CC(=N1)OP(=S)(OC)OC)CC(=O)OCC

Isomeric SMILES

CCNC1=NC(=CC(=N1)OP(=S)(OC)OC)CC(=O)OCC

InChI

InChI=1S/C12H20N3O5PS/c1-5-13-12-14-9(8-11(16)19-6-2)7-10(15-12)20-21(22,17-3)18-4/h7H,5-6,8H2,1-4H3,(H,13,14,15)