(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl pyrazine-2-carboxylate

Systemtic Name: (2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl pyrazine-2-carboxylate Openeye Name: (2-chloro-7-methylsulfanyl-3-quinolyl)methyl pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [2-chloro-7-(methylthio)-3-quinolinyl]methyl ester IUPAC Name: (2-chloro-7-methylsulfanylquinolin-3-yl)methyl pyrazine-2-carboxylate Traditional Name: pyrazinic acid [2-chloro-7-(methylthio)-3-quinolyl]methyl ester Formula: C16H12ClN3O2S MolecularWeight: 345.80338

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=NC=CN=C3)Cl

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=NC=CN=C3)Cl

InChI

InChI=1S/C16H12ClN3O2S/c1-23-12-3-2-10-6-11(15(17)20-13(10)7-12)9-22-16(21)14-8-18-4-5-19-14/h2-8H,9H2,1H3