ethyl 6,7-bis(fluoranyl)-2-methylsulfanyl-4-oxidanylidene-1-pyrazin-2-yl-quinoline-3-carboxylate

Systemtic Name: ethyl 6,7-bis(fluoranyl)-2-methylsulfanyl-4-oxidanylidene-1-pyrazin-2-yl-quinoline-3-carboxylate Openeye Name: ethyl 6,7-difluoro-2-methylsulfanyl-4-oxo-1-pyrazin-2-yl-quinoline-3-carboxylate CAS Name: 6,7-difluoro-2-(methylthio)-4-oxo-1-(2-pyrazinyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6,7-difluoro-2-methylsulfanyl-4-oxo-1-pyrazin-2-ylquinoline-3-carboxylate Traditional Name: 6,7-difluoro-4-keto-2-(methylthio)-1-pyrazin-2-yl-quinoline-3-carboxylic acid ethyl ester Formula: C17H13F2N3O3S MolecularWeight: 377.365226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C2C1=O)F)F)C3=NC=CN=C3)SC

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C2C1=O)F)F)C3=NC=CN=C3)SC

InChI

InChI=1S/C17H13F2N3O3S/c1-3-25-17(24)14-15(23)9-6-10(18)11(19)7-12(9)22(16(14)26-2)13-8-20-4-5-21-13/h4-8H,3H2,1-2H3