methyl 3-[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-1-yl]-2-diethoxyphosphoryl-prop-2-enoate

Systemtic Name: methyl 3-[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-1-yl]-2-diethoxyphosphoryl-prop-2-enoate Openeye Name: methyl 2-diethoxyphosphoryl-3-(4,6-dioxo-2-thioxo-hexahydropyrimidin-1-yl)prop-2-enoate CAS Name: 2-diethoxyphosphoryl-3-(4,6-dioxo-2-sulfanylidene-1,3-diazinan-1-yl)-2-propenoic acid methyl ester IUPAC Name: methyl 2-diethoxyphosphoryl-3-(4,6-dioxo-2-sulfanylidene-1,3-diazinan-1-yl)prop-2-enoate Traditional Name: 2-diethoxyphosphoryl-3-(4,6-diketo-2-thioxo-hexahydropyrimidin-1-yl)acrylic acid methyl ester Formula: C12H17N2O7PS MolecularWeight: 364.311341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(=CN1C(=O)CC(=O)NC1=S)C(=O)OC)OCC

Isomeric SMILES

CCOP(=O)(C(=CN1C(=O)CC(=O)NC1=S)C(=O)OC)OCC

InChI

InChI=1S/C12H17N2O7PS/c1-4-20-22(18,21-5-2)8(11(17)19-3)7-14-10(16)6-9(15)13-12(14)23/h7H,4-6H2,1-3H3,(H,13,15,23)