ethyl 4-[[2,6-bis(chloranyl)phenyl]amino]-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[[2,6-bis(chloranyl)phenyl]amino]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(2,6-dichloroanilino)-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-(2,6-dichloroanilino)-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2,6-dichloroanilino)-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-(2,6-dichloroanilino)-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C14H13Cl2N3O2S MolecularWeight: 358.24292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2=C(C=CC=C2Cl)Cl)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=C(C=CC=C2Cl)Cl)SC

InChI

InChI=1S/C14H13Cl2N3O2S/c1-3-21-13(20)8-7-17-14(22-2)19-12(8)18-11-9(15)5-4-6-10(11)16/h4-7H,3H2,1-2H3,(H,17,18,19)