4-(5-ethyl-6-methylsulfinyl-4-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl)butyl ethanoate

Systemtic Name: 4-(5-ethyl-6-methylsulfinyl-4-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl)butyl ethanoate Openeye Name: 4-(5-ethyl-6-methylsulfinyl-4-oxo-2-thioxo-pyrimidin-1-yl)butyl acetate CAS Name: acetic acid 4-(5-ethyl-6-methylsulfinyl-4-oxo-2-sulfanylidene-1-pyrimidinyl)butyl ester IUPAC Name: 4-(5-ethyl-6-methylsulfinyl-4-oxo-2-sulfanylidenepyrimidin-1-yl)butyl acetate Traditional Name: acetic acid 4-(5-ethyl-4-keto-6-methylsulfinyl-2-thioxo-pyrimidin-1-yl)butyl ester Formula: C13H20N2O4S2 MolecularWeight: 332.4389

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=S)NC1=O)CCCCOC(=O)C)S(=O)C

Isomeric SMILES

CCC1=C(N(C(=S)NC1=O)CCCCOC(=O)C)S(=O)C

InChI

InChI=1S/C13H20N2O4S2/c1-4-10-11(17)14-13(20)15(12(10)21(3)18)7-5-6-8-19-9(2)16/h4-8H2,1-3H3,(H,14,17,20)