ethyl 2-methylsulfanyl-4-(pyridin-2-ylamino)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-methylsulfanyl-4-(pyridin-2-ylamino)pyrimidine-5-carboxylate Openeye Name: ethyl 2-methylsulfanyl-4-(2-pyridylamino)pyrimidine-5-carboxylate CAS Name: 2-(methylthio)-4-(2-pyridinylamino)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-4-(pyridin-2-ylamino)pyrimidine-5-carboxylate Traditional Name: 2-(methylthio)-4-(2-pyridylamino)pyrimidine-5-carboxylic acid ethyl ester Formula: C13H14N4O2S MolecularWeight: 290.34086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2=CC=CC=N2)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=CC=CC=N2)SC

InChI

InChI=1S/C13H14N4O2S/c1-3-19-12(18)9-8-15-13(20-2)17-11(9)16-10-6-4-5-7-14-10/h4-8H,3H2,1-2H3,(H,14,15,16,17)