(2-methylquinolin-8-yl) 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxylate

Systemtic Name: (2-methylquinolin-8-yl) 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxylate Openeye Name: (2-methyl-8-quinolyl) 5-chloro-2-methylsulfanyl-pyrimidine-4-carboxylate CAS Name: 5-chloro-2-(methylthio)-4-pyrimidinecarboxylic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 5-chloro-2-methylsulfanylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-(methylthio)pyrimidine-4-carboxylic acid (2-methyl-8-quinolyl) ester Formula: C16H12ClN3O2S MolecularWeight: 345.80338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OC(=O)C3=NC(=NC=C3Cl)SC)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OC(=O)C3=NC(=NC=C3Cl)SC)C=C1

InChI

InChI=1S/C16H12ClN3O2S/c1-9-6-7-10-4-3-5-12(13(10)19-9)22-15(21)14-11(17)8-18-16(20-14)23-2/h3-8H,1-2H3