ethyl 2-[[6-(methylamino)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl]imino]ethanoate

Systemtic Name: ethyl 2-[[6-(methylamino)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl]imino]ethanoate Openeye Name: ethyl 2-[[6-(methylamino)-4-oxo-2-thioxo-1H-pyrimidin-5-yl]imino]acetate CAS Name: 2-[[6-(methylamino)-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl]imino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[6-(methylamino)-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl]imino]acetate Traditional Name: 2-[[4-keto-6-(methylamino)-2-thioxo-1H-pyrimidin-5-yl]imino]acetic acid ethyl ester Formula: C9H12N4O3S MolecularWeight: 256.28158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=NC1=C(NC(=S)NC1=O)NC

Isomeric SMILES

CCOC(=O)C=NC1=C(NC(=S)NC1=O)NC

InChI

InChI=1S/C9H12N4O3S/c1-3-16-5(14)4-11-6-7(10-2)12-9(17)13-8(6)15/h4H,3H2,1-2H3,(H3,10,12,13,15,17)