ethyl 2-methylsulfanyl-4-pyridin-4-ylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-methylsulfanyl-4-pyridin-4-ylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 2-methylsulfanyl-4-(4-pyridylsulfanyl)pyrimidine-5-carboxylate CAS Name: 2-(methylthio)-4-(pyridin-4-ylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-4-pyridin-4-ylsulfanylpyrimidine-5-carboxylate Traditional Name: 2-(methylthio)-4-(4-pyridylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C13H13N3O2S2 MolecularWeight: 307.39122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1SC2=CC=NC=C2)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1SC2=CC=NC=C2)SC

InChI

InChI=1S/C13H13N3O2S2/c1-3-18-12(17)10-8-15-13(19-2)16-11(10)20-9-4-6-14-7-5-9/h4-8H,3H2,1-2H3