pyridin-3-yl 5-chloranyl-2-ethylsulfanyl-pyrimidine-4-carboxylate

Systemtic Name: pyridin-3-yl 5-chloranyl-2-ethylsulfanyl-pyrimidine-4-carboxylate Openeye Name: 3-pyridyl 5-chloro-2-ethylsulfanyl-pyrimidine-4-carboxylate CAS Name: 5-chloro-2-(ethylthio)-4-pyrimidinecarboxylic acid 3-pyridinyl ester IUPAC Name: pyridin-3-yl 5-chloro-2-ethylsulfanylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-(ethylthio)pyrimidine-4-carboxylic acid 3-pyridyl ester Formula: C12H10ClN3O2S MolecularWeight: 295.7447

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C(=N1)C(=O)OC2=CN=CC=C2)Cl

Isomeric SMILES

CCSC1=NC=C(C(=N1)C(=O)OC2=CN=CC=C2)Cl

InChI

InChI=1S/C12H10ClN3O2S/c1-2-19-12-15-7-9(13)10(16-12)11(17)18-8-4-3-5-14-6-8/h3-7H,2H2,1H3